11-[3-(methylamino)-5-phenyl-thiophen-2-yl]undecanoic acid

Systemtic Name: 11-[3-(methylamino)-5-phenyl-thiophen-2-yl]undecanoic acid Openeye Name: 11-[3-(methylamino)-5-phenyl-2-thienyl]undecanoic acid CAS Name: 11-[3-(methylamino)-5-phenyl-2-thiophenyl]undecanoic acid IUPAC Name: 11-[3-(methylamino)-5-phenylthiophen-2-yl]undecanoic acid Traditional Name: 11-[3-(methylamino)-5-phenyl-2-thienyl]undecanoic acid Formula: C22H31NO2S MolecularWeight: 373.55204

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(SC(=C1)C2=CC=CC=C2)CCCCCCCCCCC(=O)O

Isomeric SMILES

CNC1=C(SC(=C1)C2=CC=CC=C2)CCCCCCCCCCC(=O)O

InChI

InChI=1S/C22H31NO2S/c1-23-19-17-21(18-13-9-8-10-14-18)26-20(19)15-11-6-4-2-3-5-7-12-16-22(24)25/h8-10,13-14,17,23H,2-7,11-12,15-16H2,1H3,(H,24,25)