2-phenoxyethyl (4S)-6-methyl-4-(4-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate

Systemtic Name: 2-phenoxyethyl (4S)-6-methyl-4-(4-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: 2-phenoxyethyl (4S)-6-methyl-4-(4-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: (4S)-6-methyl-4-(4-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl (4S)-6-methyl-4-(4-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: (4S)-2-keto-6-methyl-4-(4-nitrophenyl)-3,4-dihydro-1H-pyridine-5-carboxylic acid 2-phenoxyethyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=O)N1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCOC3=CC=CC=C3

Isomeric SMILES

CC1=C([C@@H](CC(=O)N1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCCOC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O6/c1-14-20(21(25)29-12-11-28-17-5-3-2-4-6-17)18(13-19(24)22-14)15-7-9-16(10-8-15)23(26)27/h2-10,18H,11-13H2,1H3,(H,22,24)/t18-/m0/s1