dimethyl 10-[(E)-2-nitroethenyl]-6-oxidanyl-7,8-dihydro-6H-pyrido[1,2-a]indole-9,9-dicarboxylate

Systemtic Name: dimethyl 10-[(E)-2-nitroethenyl]-6-oxidanyl-7,8-dihydro-6H-pyrido[1,2-a]indole-9,9-dicarboxylate Openeye Name: dimethyl 6-hydroxy-10-[(E)-2-nitrovinyl]-7,8-dihydro-6H-pyrido[1,2-a]indole-9,9-dicarboxylate CAS Name: 6-hydroxy-10-[(E)-2-nitroethenyl]-7,8-dihydro-6H-pyrido[1,2-a]indole-9,9-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 6-hydroxy-10-[(E)-2-nitroethenyl]-7,8-dihydro-6H-pyrido[1,2-a]indole-9,9-dicarboxylate Traditional Name: 6-hydroxy-10-[(E)-2-nitrovinyl]-7,8-dihydro-6H-pyrid[1,2-a]indole-9,9-dicarboxylic acid dimethyl ester Formula: C18H18N2O7 MolecularWeight: 374.34472

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCC(N2C1=C(C3=CC=CC=C32)C=C[N+](=O)[O-])O)C(=O)OC

Isomeric SMILES

COC(=O)C1(CCC(N2C1=C(C3=CC=CC=C32)/C=C/[N+](=O)[O-])O)C(=O)OC

InChI

InChI=1S/C18H18N2O7/c1-26-16(22)18(17(23)27-2)9-7-14(21)20-13-6-4-3-5-11(13)12(15(18)20)8-10-19(24)25/h3-6,8,10,14,21H,7,9H2,1-2H3/b10-8+