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

Systemtic Name: 1-[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-(2-benzylanilino)-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-oxo-2-[2-(phenylmethyl)anilino]ethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-(2-benzylanilino)-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-(2-benzylanilino)-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CC(=O)NC2=CC=CC=C2CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(CC(=O)NC2=CC=CC=C2CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H27NO3/c25-21(17-23(22(26)27)14-8-1-2-9-15-23)24-20-13-7-6-12-19(20)16-18-10-4-3-5-11-18/h3-7,10-13H,1-2,8-9,14-17H2,(H,24,25)(H,26,27)