기본 정보
- 표준 SMILES
COC(=O)C1CC(O)CN1S(=O)(=O)c1ccc(OC)c(OC)c1- InChIKey
XTXWFTASVNOQGN-UHFFFAOYSA-N- 분자식
- C14H19NO7S
- 평균 분자량
- 345.37 g/mol
이름 및 식별자
- 우선 이름
- Methyl 1-[(3,4-dimethoxyphenyl)sulfonyl]-4-hydroxy-2-pyrrolidinecarboxylate
- IUPAC
- methyl 1-(3,4-dimethoxyphenyl)sulfonyl-4-hydroxypyrrolidine-2-carboxylate
이름 및 동의어
251310-35-7methyl 1-[(3,4-dimethoxyphenyl)sulfonyl]-4-hydroxy-2-pyrrolidinecarboxylateMFCD00202701methyl 1-(3,4-dimethoxybenzenesulfonyl)-4-hydroxypyrrolidine-2-carboxylatemethyl 1-(3,4-dimethoxyphenyl)sulfonyl-4-hydroxypyrrolidine-2-carboxylateMethyl 1-[(3,4-dimethoxyphenyl)sulfonyl]-4- hydroxy-2-pyrrolidinecarboxylateOprea1_400344AKOS00507461110G-926Methyl 1-((3,4-dimethoxyphenyl)sulfonyl)-4-hydroxypyrrolidine-2-carboxylatemethyl 1-(3,4-dimethoxyphenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylatemethyl1-(3,4-dimethoxybenzenesulfonyl)-4-hydroxypyrrolidine-2-carboxylate
데이터베이스 식별자
- PubChem CID
- 2765102
물성
구조 계산 물성
- XLogP
- 0.5
- 극성 표면적
- 111 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 518
관련 반응
2건
연결된 노트
불러오는 중…