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

Systemtic Name: ethyl 2-[(4,5-dimethoxy-2-nitro-phenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)N=CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)N=CC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H22N2O6S/c1-4-28-20(23)18-13-7-5-6-8-17(13)29-19(18)21-11-12-9-15(26-2)16(27-3)10-14(12)22(24)25/h9-11H,4-8H2,1-3H3