4-[3-[4-(2-nitrophenyl)phenyl]propanoylamino]thiophene-3-carboxylic acid

Systemtic Name: 4-[3-[4-(2-nitrophenyl)phenyl]propanoylamino]thiophene-3-carboxylic acid Openeye Name: 4-[3-[4-(2-nitrophenyl)phenyl]propanoylamino]thiophene-3-carboxylic acid CAS Name: 4-[[3-[4-(2-nitrophenyl)phenyl]-1-oxopropyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4-[3-[4-(2-nitrophenyl)phenyl]propanoylamino]thiophene-3-carboxylic acid Traditional Name: 4-[3-[4-(2-nitrophenyl)phenyl]propanoylamino]-3-thenoic acid Formula: C20H16N2O5S MolecularWeight: 396.41644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)CCC(=O)NC3=CSC=C3C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)CCC(=O)NC3=CSC=C3C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C20H16N2O5S/c23-19(21-17-12-28-11-16(17)20(24)25)10-7-13-5-8-14(9-6-13)15-3-1-2-4-18(15)22(26)27/h1-6,8-9,11-12H,7,10H2,(H,21,23)(H,24,25)