2-[4-(4-thiophen-2-ylbutylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(4-thiophen-2-ylbutylamino)phenyl]ethanoic acid Openeye Name: 2-[4-[4-(2-thienyl)butylamino]phenyl]acetic acid CAS Name: 2-[4-(4-thiophen-2-ylbutylamino)phenyl]acetic acid IUPAC Name: 2-[4-(4-thiophen-2-ylbutylamino)phenyl]acetic acid Traditional Name: 2-[4-[4-(2-thienyl)butylamino]phenyl]acetic acid Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCCCNC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

C1=CSC(=C1)CCCCNC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C16H19NO2S/c18-16(19)12-13-6-8-14(9-7-13)17-10-2-1-4-15-5-3-11-20-15/h3,5-9,11,17H,1-2,4,10,12H2,(H,18,19)