ethyl 2-[3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoylamino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(3-bromanyl-4-methoxy-phenyl)prop-2-enoylamino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(3-bromo-4-methoxy-phenyl)prop-2-enoylamino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[[3-(3-bromo-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-5-methyl-4-(4-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(3-bromo-4-methoxyphenyl)prop-2-enoylamino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[[3-(3-bromo-4-methoxy-phenyl)acryloyl]amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C24H21BrN2O6S MolecularWeight: 545.40234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)NC(=O)C=CC3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)NC(=O)C=CC3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C24H21BrN2O6S/c1-4-33-24(29)22-21(16-7-9-17(10-8-16)27(30)31)14(2)34-23(22)26-20(28)12-6-15-5-11-19(32-3)18(25)13-15/h5-13H,4H2,1-3H3,(H,26,28)