ethyl 4-(3,4-dimethoxyphenyl)-2-[(5-nitrothiophen-2-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[(5-nitrothiophen-2-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[(5-nitrothiophene-2-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-2-[[(5-nitro-2-thiophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[(5-nitrothiophene-2-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-2-[(5-nitrothiophene-2-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H18N2O7S2 MolecularWeight: 462.49612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O7S2/c1-4-29-20(24)17-12(11-5-6-13(27-2)14(9-11)28-3)10-30-19(17)21-18(23)15-7-8-16(31-15)22(25)26/h5-10H,4H2,1-3H3,(H,21,23)