[(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] cyclopentanecarboxylate

Systemtic Name: [(1S)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] cyclopentanecarboxylate Openeye Name: [(1S)-2-(2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [(1S)-2-keto-2-(2-methoxy-5-methyl-anilino)-1-phenyl-ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO4/c1-15-12-13-19(26-2)18(14-15)23-21(24)20(16-8-4-3-5-9-16)27-22(25)17-10-6-7-11-17/h3-5,8-9,12-14,17,20H,6-7,10-11H2,1-2H3,(H,23,24)/t20-/m0/s1