2-[2-[3-(methylamino)-5-phenyl-thiophen-2-yl]ethyl]benzoic acid

Systemtic Name: 2-[2-[3-(methylamino)-5-phenyl-thiophen-2-yl]ethyl]benzoic acid Openeye Name: 2-[2-[3-(methylamino)-5-phenyl-2-thienyl]ethyl]benzoic acid CAS Name: 2-[2-[3-(methylamino)-5-phenyl-2-thiophenyl]ethyl]benzoic acid IUPAC Name: 2-[2-[3-(methylamino)-5-phenylthiophen-2-yl]ethyl]benzoic acid Traditional Name: 2-[2-[3-(methylamino)-5-phenyl-2-thienyl]ethyl]benzoic acid Formula: C20H19NO2S MolecularWeight: 337.43536

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(SC(=C1)C2=CC=CC=C2)CCC3=CC=CC=C3C(=O)O

Isomeric SMILES

CNC1=C(SC(=C1)C2=CC=CC=C2)CCC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H19NO2S/c1-21-17-13-19(15-8-3-2-4-9-15)24-18(17)12-11-14-7-5-6-10-16(14)20(22)23/h2-10,13,21H,11-12H2,1H3,(H,22,23)