Carbanilic acid, 4-(3-(methoxycarbonyl)propyl)-, benzyl ester
Basic information
- CAS
4252-28-2- Standard SMILES
COC(=O)CCCc1ccc(NC(=O)OCc2ccccc2)cc1- InChIKey
RNHLZVAKVRCBJV-UHFFFAOYSA-N- Molecular formula
- C19H21NO4
- Average molar mass
- 327.4 g/mol
- Monoisotopic mass
- 327.14705815
Names & identifiers
- Preferred name
- Carbanilic acid, 4-(3-(methoxycarbonyl)propyl)-, benzyl ester
- IUPAC
- methyl 4-[4-(phenylmethoxycarbonylamino)phenyl]butanoate
Names & synonyms
RMA3KU4KWO4252-28-2CARBANILIC ACID, 4-(3-(METHOXYCARBONYL)PROPYL)-, BENZYL ESTERNSC 85210BRN 2774518UNII-RMA3KU4KWONSC-85210Methyl-4-(p-(benzyloxycarbonylamino)-phenyl)butyrateDTXSID40195303CARBANILIC ACID, P-(3-CARBOXYPROPYL)-, N-BENZYL METHYL ESTERBENZENEBUTANOIC ACID, 4-(((PHENYLMETHOXY)CARBONYL)AMINO)-, METHYL ESTERRefChem:123470
Show more names
DTXCID10117794NSC85210methyl 4-(4-{[(benzyloxy)carbonyl]amino}phenyl)butanoate
Database identifiers
- CAS
4252-28-2- PubChem CID
- 20247
- DTXSID
DTXSID40195303- UNII
- RMA3KU4KWO
- Nikkaji
- J69.449E
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 385
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Related reactions
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Compound notes
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