[(1S)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] cyclopentanecarboxylate

Systemtic Name: [(1S)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] cyclopentanecarboxylate Openeye Name: [(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenyl-ethyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [(1S)-2-(2,5-dimethylanilino)-2-keto-1-phenyl-ethyl] ester Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)OC(=O)C3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@H](C2=CC=CC=C2)OC(=O)C3CCCC3

InChI

InChI=1S/C22H25NO3/c1-15-12-13-16(2)19(14-15)23-21(24)20(17-8-4-3-5-9-17)26-22(25)18-10-6-7-11-18/h3-5,8-9,12-14,18,20H,6-7,10-11H2,1-2H3,(H,23,24)/t20-/m0/s1