methyl 2-azanyl-4-(2-chloranyl-5-nitro-phenyl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydrochromene-3-carboxylate

Systemtic Name: methyl 2-azanyl-4-(2-chloranyl-5-nitro-phenyl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydrochromene-3-carboxylate Openeye Name: methyl 2-amino-4-(2-chloro-5-nitro-phenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromene-3-carboxylate CAS Name: 2-amino-4-(2-chloro-5-nitrophenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(2-chloro-5-nitrophenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromene-3-carboxylate Traditional Name: 2-amino-4-(2-chloro-5-nitro-phenyl)-5-keto-7-phenyl-4,6,7,8-tetrahydrochromene-3-carboxylic acid methyl ester Formula: C23H19ClN2O6 MolecularWeight: 454.85976

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC2=C(C1C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C(=O)CC(C2)C4=CC=CC=C4)N

Isomeric SMILES

COC(=O)C1=C(OC2=C(C1C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C(=O)CC(C2)C4=CC=CC=C4)N

InChI

InChI=1S/C23H19ClN2O6/c1-31-23(28)21-19(15-11-14(26(29)30)7-8-16(15)24)20-17(27)9-13(10-18(20)32-22(21)25)12-5-3-2-4-6-12/h2-8,11,13,19H,9-10,25H2,1H3