1-[(3-methoxyphenyl)carbonylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[(3-methoxyphenyl)carbonylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[(3-methoxybenzoyl)amino]cycloheptanecarboxylic acid CAS Name: 1-[[(3-methoxyphenyl)-oxomethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[(3-methoxybenzoyl)amino]cycloheptane-1-carboxylic acid Traditional Name: 1-(m-anisoylamino)cycloheptanecarboxylic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2(CCCCCC2)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2(CCCCCC2)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-21-13-8-6-7-12(11-13)14(18)17-16(15(19)20)9-4-2-3-5-10-16/h6-8,11H,2-5,9-10H2,1H3,(H,17,18)(H,19,20)