dimethyl 3-methanoyl-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylate

Systemtic Name: dimethyl 3-methanoyl-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylate Openeye Name: dimethyl 3-formyl-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylate CAS Name: 3-formyl-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-formyl-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylate Traditional Name: 3-formyl-4-(nitromethyl)-2,3,4,9-tetrahydrocarbazole-1,1-dicarboxylic acid dimethyl ester Formula: C18H18N2O7 MolecularWeight: 374.34472

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(C(C2=C1NC3=CC=CC=C32)C[N+](=O)[O-])C=O)C(=O)OC

Isomeric SMILES

COC(=O)C1(CC(C(C2=C1NC3=CC=CC=C32)C[N+](=O)[O-])C=O)C(=O)OC

InChI

InChI=1S/C18H18N2O7/c1-26-16(22)18(17(23)27-2)7-10(9-21)12(8-20(24)25)14-11-5-3-4-6-13(11)19-15(14)18/h3-6,9-10,12,19H,7-8H2,1-2H3