[(2S)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] (3S)-1-(2-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [(2S)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] (3S)-1-(2-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [(1S)-2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] (3S)-1-(2-ethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-ethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [(2S)-1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-cyanoanilino)-1-oxopropan-2-yl] (3S)-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2-ethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [(1S)-2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2CC(CC2=O)C(=O)OC(C)C(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

CCC1=CC=CC=C1N2C[C@H](CC2=O)C(=O)O[C@@H](C)C(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C23H23N3O4/c1-3-16-8-5-7-11-20(16)26-14-18(12-21(26)27)23(29)30-15(2)22(28)25-19-10-6-4-9-17(19)13-24/h4-11,15,18H,3,12,14H2,1-2H3,(H,25,28)/t15-,18-/m0/s1