ethyl 6-chloranyl-2-methyl-4-(3-nitrophenyl)-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-2-methyl-4-(3-nitrophenyl)-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: ethyl 6-chloro-2-methyl-4-(3-nitrophenyl)-1-oxo-isoquinoline-3-carboxylate CAS Name: 6-chloro-2-methyl-4-(3-nitrophenyl)-1-oxo-3-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-2-methyl-4-(3-nitrophenyl)-1-oxoisoquinoline-3-carboxylate Traditional Name: 6-chloro-1-keto-2-methyl-4-(3-nitrophenyl)isoquinoline-3-carboxylic acid ethyl ester Formula: C19H15ClN2O5 MolecularWeight: 386.7858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15ClN2O5/c1-3-27-19(24)17-16(11-5-4-6-13(9-11)22(25)26)15-10-12(20)7-8-14(15)18(23)21(17)2/h4-10H,3H2,1-2H3