methyl 3-nitro-2-oxidanyl-6,11-bis(oxidanylidene)-5-(phenylmethyl)benzo[b]carbazole-1-carboxylate

Systemtic Name: methyl 3-nitro-2-oxidanyl-6,11-bis(oxidanylidene)-5-(phenylmethyl)benzo[b]carbazole-1-carboxylate Openeye Name: methyl 5-benzyl-2-hydroxy-3-nitro-6,11-dioxo-benzo[b]carbazole-1-carboxylate CAS Name: 2-hydroxy-3-nitro-6,11-dioxo-5-(phenylmethyl)-1-benzo[b]carbazolecarboxylic acid methyl ester IUPAC Name: methyl 5-benzyl-2-hydroxy-3-nitro-6,11-dioxobenzo[b]carbazole-1-carboxylate Traditional Name: 5-benzyl-2-hydroxy-6,11-diketo-3-nitro-benzo[b]carbazole-1-carboxylic acid methyl ester Formula: C25H16N2O7 MolecularWeight: 456.40374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CC(=C1O)[N+](=O)[O-])N(C3=C2C(=O)C4=CC=CC=C4C3=O)CC5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=C2C(=CC(=C1O)[N+](=O)[O-])N(C3=C2C(=O)C4=CC=CC=C4C3=O)CC5=CC=CC=C5

InChI

InChI=1S/C25H16N2O7/c1-34-25(31)20-18-16(11-17(24(20)30)27(32)33)26(12-13-7-3-2-4-8-13)21-19(18)22(28)14-9-5-6-10-15(14)23(21)29/h2-11,30H,12H2,1H3