methyl 2-[(4,5-dimethoxy-2-nitro-phenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[(4,5-dimethoxy-2-nitro-phenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[(4,5-dimethoxy-2-nitro-phenyl)methyleneamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[(4,5-dimethoxy-2-nitrophenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4,5-dimethoxy-2-nitrophenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[(4,5-dimethoxy-2-nitro-benzylidene)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=NC2=C(C3=C(S2)CCCC3)C(=O)OC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C=NC2=C(C3=C(S2)CCCC3)C(=O)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C19H20N2O6S/c1-25-14-8-11(13(21(23)24)9-15(14)26-2)10-20-18-17(19(22)27-3)12-6-4-5-7-16(12)28-18/h8-10H,4-7H2,1-3H3