methyl 9-methoxy-1,2-bis(3-nitrophenyl)-8-oxidanyl-pyrrolo[2,1-a]isoquinoline-3-carboxylate

Systemtic Name: methyl 9-methoxy-1,2-bis(3-nitrophenyl)-8-oxidanyl-pyrrolo[2,1-a]isoquinoline-3-carboxylate Openeye Name: methyl 8-hydroxy-9-methoxy-1,2-bis(3-nitrophenyl)pyrrolo[2,1-a]isoquinoline-3-carboxylate CAS Name: 8-hydroxy-9-methoxy-1,2-bis(3-nitrophenyl)-3-pyrrolo[2,1-a]isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 8-hydroxy-9-methoxy-1,2-bis(3-nitrophenyl)pyrrolo[2,1-a]isoquinoline-3-carboxylate Traditional Name: 8-hydroxy-9-methoxy-1,2-bis(3-nitrophenyl)pyrrol[2,1-a]isoquinoline-3-carboxylic acid methyl ester Formula: C27H19N3O8 MolecularWeight: 513.45506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=CN3C(=C(C(=C3C(=O)OC)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC(=CC=C5)[N+](=O)[O-])C2=C1)O

Isomeric SMILES

COC1=C(C=C2C=CN3C(=C(C(=C3C(=O)OC)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC(=CC=C5)[N+](=O)[O-])C2=C1)O

InChI

InChI=1S/C27H19N3O8/c1-37-22-14-20-15(13-21(22)31)9-10-28-25(20)23(16-5-3-7-18(11-16)29(33)34)24(26(28)27(32)38-2)17-6-4-8-19(12-17)30(35)36/h3-14,31H,1-2H3