1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-(benzylamino)-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-oxo-2-[(phenylmethyl)amino]ethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-(benzylamino)-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-(benzylamino)-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CC(=O)NCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(CC(=O)NCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H23NO3/c19-15(18-13-14-8-4-3-5-9-14)12-17(16(20)21)10-6-1-2-7-11-17/h3-5,8-9H,1-2,6-7,10-13H2,(H,18,19)(H,20,21)