2-phenoxyethyl (4S,7R)-2-methyl-4-(4-nitrophenyl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: 2-phenoxyethyl (4S,7R)-2-methyl-4-(4-nitrophenyl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: 2-phenoxyethyl (4S,7R)-2-methyl-4-(4-nitrophenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (4S,7R)-2-methyl-4-(4-nitrophenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl (4S,7R)-2-methyl-4-(4-nitrophenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (4S,7R)-5-keto-2-methyl-4-(4-nitrophenyl)-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid 2-phenoxyethyl ester Formula: C31H28N2O6 MolecularWeight: 524.56382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OCCOC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)CC(C2)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OCCOC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)C[C@@H](C2)C5=CC=CC=C5

InChI

InChI=1S/C31H28N2O6/c1-20-28(31(35)39-17-16-38-25-10-6-3-7-11-25)29(22-12-14-24(15-13-22)33(36)37)30-26(32-20)18-23(19-27(30)34)21-8-4-2-5-9-21/h2-15,23,28-29H,16-19H2,1H3/t23-,28?,29-/m1/s1