2-[4-[[[4-(4-phenylmethoxyphenyl)thiophen-2-yl]carbonylamino]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[[[4-(4-phenylmethoxyphenyl)thiophen-2-yl]carbonylamino]methyl]phenyl]ethanoic acid Openeye Name: 2-[4-[[[4-(4-benzyloxyphenyl)thiophene-2-carbonyl]amino]methyl]phenyl]acetic acid CAS Name: 2-[4-[[[oxo-[4-(4-phenylmethoxyphenyl)-2-thiophenyl]methyl]amino]methyl]phenyl]acetic acid IUPAC Name: 2-[4-[[[4-(4-phenylmethoxyphenyl)thiophene-2-carbonyl]amino]methyl]phenyl]acetic acid Traditional Name: 2-[4-[[[4-(4-benzoxyphenyl)thiophene-2-carbonyl]amino]methyl]phenyl]acetic acid Formula: C27H23NO4S MolecularWeight: 457.54082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=CSC(=C3)C(=O)NCC4=CC=C(C=C4)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=CSC(=C3)C(=O)NCC4=CC=C(C=C4)CC(=O)O

InChI

InChI=1S/C27H23NO4S/c29-26(30)14-19-6-8-20(9-7-19)16-28-27(31)25-15-23(18-33-25)22-10-12-24(13-11-22)32-17-21-4-2-1-3-5-21/h1-13,15,18H,14,16-17H2,(H,28,31)(H,29,30)