1-[(3,5-dimethylphenyl)carbonylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[(3,5-dimethylphenyl)carbonylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[(3,5-dimethylbenzoyl)amino]cycloheptanecarboxylic acid CAS Name: 1-[[(3,5-dimethylphenyl)-oxomethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[(3,5-dimethylbenzoyl)amino]cycloheptane-1-carboxylic acid Traditional Name: 1-[(3,5-dimethylbenzoyl)amino]cycloheptanecarboxylic acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC2(CCCCCC2)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC2(CCCCCC2)C(=O)O)C

InChI

InChI=1S/C17H23NO3/c1-12-9-13(2)11-14(10-12)15(19)18-17(16(20)21)7-5-3-4-6-8-17/h9-11H,3-8H2,1-2H3,(H,18,19)(H,20,21)