1-[2-(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonyloxyethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonyloxyethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(4-amino-5-chloro-2-methoxy-benzoyl)oxyethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[(4-amino-5-chloro-2-methoxyphenyl)-oxomethoxy]ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(4-amino-5-chloro-2-methoxybenzoyl)oxyethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(4-amino-5-chloro-2-methoxy-benzoyl)oxyethyl]isonipecotic acid Formula: C16H21ClN2O5 MolecularWeight: 356.80134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)C(=O)O)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)C(=O)O)Cl)N

InChI

InChI=1S/C16H21ClN2O5/c1-23-14-9-13(18)12(17)8-11(14)16(22)24-7-6-19-4-2-10(3-5-19)15(20)21/h8-10H,2-7,18H2,1H3,(H,20,21)