3-methyl-2-[[5-(4-methylphenyl)thiophen-2-yl]methylamino]butanoic acid

Systemtic Name: 3-methyl-2-[[5-(4-methylphenyl)thiophen-2-yl]methylamino]butanoic acid Openeye Name: 3-methyl-2-[[5-(p-tolyl)-2-thienyl]methylamino]butanoic acid CAS Name: 3-methyl-2-[[5-(4-methylphenyl)-2-thiophenyl]methylamino]butanoic acid IUPAC Name: 3-methyl-2-[[5-(4-methylphenyl)thiophen-2-yl]methylamino]butanoic acid Traditional Name: 3-methyl-2-[[5-(p-tolyl)-2-thienyl]methylamino]butyric acid Formula: C17H21NO2S MolecularWeight: 303.41914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(S2)CNC(C(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(S2)CNC(C(C)C)C(=O)O

InChI

InChI=1S/C17H21NO2S/c1-11(2)16(17(19)20)18-10-14-8-9-15(21-14)13-6-4-12(3)5-7-13/h4-9,11,16,18H,10H2,1-3H3,(H,19,20)