[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-cyclohexyl-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-cyclohexyl-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl] (3S)-1-cyclohexyl-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-cyclohexyl-5-oxo-3-pyrrolidinecarboxylic acid [2-(3-chloro-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-2-methylanilino)-2-oxoethyl] (3S)-1-cyclohexyl-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-cyclohexyl-5-keto-pyrrolidine-3-carboxylic acid [2-(3-chloro-2-methyl-anilino)-2-keto-ethyl] ester Formula: C20H25ClN2O4 MolecularWeight: 392.8765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)COC(=O)C2CC(=O)N(C2)C3CCCCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)COC(=O)[C@H]2CC(=O)N(C2)C3CCCCC3

InChI

InChI=1S/C20H25ClN2O4/c1-13-16(21)8-5-9-17(13)22-18(24)12-27-20(26)14-10-19(25)23(11-14)15-6-3-2-4-7-15/h5,8-9,14-15H,2-4,6-7,10-12H2,1H3,(H,22,24)/t14-/m0/s1