(phenylmethyl) (2S)-3-methyl-2-[(2R)-2-(4-nitrophenyl)-4-oxidanylidene-2,3-dihydropyridin-1-yl]pentanoate

Systemtic Name: (phenylmethyl) (2S)-3-methyl-2-[(2R)-2-(4-nitrophenyl)-4-oxidanylidene-2,3-dihydropyridin-1-yl]pentanoate Openeye Name: benzyl (2S)-3-methyl-2-[(2R)-2-(4-nitrophenyl)-4-oxo-2,3-dihydropyridin-1-yl]pentanoate CAS Name: (2S)-3-methyl-2-[(2R)-2-(4-nitrophenyl)-4-oxo-2,3-dihydropyridin-1-yl]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-3-methyl-2-[(2R)-2-(4-nitrophenyl)-4-oxo-2,3-dihydropyridin-1-yl]pentanoate Traditional Name: (2S)-2-[(2R)-4-keto-2-(4-nitrophenyl)-2,3-dihydropyridin-1-yl]-3-methyl-valeric acid benzyl ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC1=CC=CC=C1)N2C=CC(=O)CC2C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(C)[C@@H](C(=O)OCC1=CC=CC=C1)N2C=CC(=O)C[C@@H]2C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H26N2O5/c1-3-17(2)23(24(28)31-16-18-7-5-4-6-8-18)25-14-13-21(27)15-22(25)19-9-11-20(12-10-19)26(29)30/h4-14,17,22-23H,3,15-16H2,1-2H3/t17?,22-,23+/m1/s1