Isopropyl 4-[4-(benzyloxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
기본 정보
- CAS
294197-76-5- 표준 SMILES
CC1=C(C(=O)OC(C)C)C(c2ccc(OCc3ccccc3)cc2)C2=C(CC(C)(C)CC2=O)N1- InChIKey
IISBWMNLZODLFV-UHFFFAOYSA-N- 분자식
- C29H33NO4
- 평균 분자량
- 459.6 g/mol
이름 및 식별자
- 우선 이름
- Isopropyl 4-[4-(benzyloxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
- IUPAC
- propan-2-yl 2,7,7-trimethyl-5-oxo-4-(4-phenylmethoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate
- 영어명
- isopropyl 4-[4-(benzyloxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
- 분자식
- C29H33NO4
- 분자량
- 459.58
이름 및 동의어
294197-76-5isopropyl 4-[4-(benzyloxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylateOprea1_699746Oprea1_773351propan-2-yl 2,7,7-trimethyl-5-oxo-4-(4-phenylmethoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylateSTL510312AKOS000650765AKOS022104572AKOS037490853ST50001778AG-690/33056036isopropyl 4-(4-(benzyloxy)phenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
이름 더 보기
3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-4-[4-(phenylmethoxy)phenyl]-, 1-methylethyl ester
methylethyl 2,7,7-trimethyl-5-oxo-4-[4-(phenylmethoxy)phenyl]-1,4,6,7,8-pentah ydroquinoline-3-carboxylatepropan-2-yl 4-[4-(benzyloxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylatepropan-2-yl 4-[4-(benzyloxy)phenyl]-5-hydroxy-2,7,7-trimethyl-4,6,7,8-tetrahydroquinoline-3-carboxylate
데이터베이스 식별자
- CAS
294197-76-5
물성
구조 계산 물성
- XLogP
- 5.5
- 극성 표면적
- 64.6 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 838
관련 반응
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