[2-[(2S)-butan-2-yl]phenyl] (3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(2S)-butan-2-yl]phenyl] (3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-[(1S)-1-methylpropyl]phenyl] (3S)-1-(4-ethoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-[(2S)-butan-2-yl]phenyl] ester IUPAC Name: [2-[(2S)-butan-2-yl]phenyl] (3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-p-phenetyl-pyrrolidine-3-carboxylic acid [2-[(1S)-1-methylpropyl]phenyl] ester Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)OCC

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OC(=O)[C@H]2CC(=O)N(C2)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C23H27NO4/c1-4-16(3)20-8-6-7-9-21(20)28-23(26)17-14-22(25)24(15-17)18-10-12-19(13-11-18)27-5-2/h6-13,16-17H,4-5,14-15H2,1-3H3/t16-,17-/m0/s1