ethyl 2-[3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[[3-(4-ethoxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-4-(3-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-ethoxy-3-methoxyphenyl)prop-2-enoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[[3-(4-ethoxy-3-methoxy-phenyl)acryloyl]amino]-4-(3-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H24N2O7S MolecularWeight: 496.53226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC)OC

InChI

InChI=1S/C25H24N2O7S/c1-4-33-20-11-9-16(13-21(20)32-3)10-12-22(28)26-24-23(25(29)34-5-2)19(15-35-24)17-7-6-8-18(14-17)27(30)31/h6-15H,4-5H2,1-3H3,(H,26,28)