2-[[3-ethoxycarbonyl-4-(4-phenylphenyl)thiophen-2-yl]carbamoyl]benzoic acid

Systemtic Name: 2-[[3-ethoxycarbonyl-4-(4-phenylphenyl)thiophen-2-yl]carbamoyl]benzoic acid Openeye Name: 2-[[3-ethoxycarbonyl-4-(4-phenylphenyl)-2-thienyl]carbamoyl]benzoic acid CAS Name: 2-[[[3-ethoxycarbonyl-4-(4-phenylphenyl)-2-thiophenyl]amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[3-ethoxycarbonyl-4-(4-phenylphenyl)thiophen-2-yl]carbamoyl]benzoic acid Traditional Name: 2-[[3-carbethoxy-4-(4-phenylphenyl)-2-thienyl]carbamoyl]benzoic acid Formula: C27H21NO5S MolecularWeight: 471.52434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C27H21NO5S/c1-2-33-27(32)23-22(19-14-12-18(13-15-19)17-8-4-3-5-9-17)16-34-25(23)28-24(29)20-10-6-7-11-21(20)26(30)31/h3-16H,2H2,1H3,(H,28,29)(H,30,31)