ethyl 4-(3-nitrophenyl)-2-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3-nitrophenyl)-2-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(1-methyl-1-phenyl-ethyl)phenoxy]acetyl]amino]-4-(3-nitrophenyl)thiophene-3-carboxylate CAS Name: 4-(3-nitrophenyl)-2-[[1-oxo-2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-nitrophenyl)-2-[[2-[4-(2-phenylpropan-2-yl)phenoxy]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(4-cumylphenoxy)acetyl]amino]-4-(3-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C30H28N2O6S MolecularWeight: 544.61812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)COC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)COC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C30H28N2O6S/c1-4-37-29(34)27-25(20-9-8-12-23(17-20)32(35)36)19-39-28(27)31-26(33)18-38-24-15-13-22(14-16-24)30(2,3)21-10-6-5-7-11-21/h5-17,19H,4,18H2,1-3H3,(H,31,33)