ethyl 2-[(2-acetyloxy-5-nitro-phenyl)carbonylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-acetyloxy-5-nitro-phenyl)carbonylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-acetoxy-5-nitro-benzoyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(2-acetyloxy-5-nitrophenyl)-oxomethyl]amino]-4-(4-ethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-acetyloxy-5-nitrobenzoyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[(2-acetoxy-5-nitro-benzoyl)amino]-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H22N2O8S MolecularWeight: 498.50508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC(=O)C

InChI

InChI=1S/C24H22N2O8S/c1-4-32-17-9-6-15(7-10-17)19-13-35-23(21(19)24(29)33-5-2)25-22(28)18-12-16(26(30)31)8-11-20(18)34-14(3)27/h6-13H,4-5H2,1-3H3,(H,25,28)