3-[1-(4-ethylphenyl)ethylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[1-(4-ethylphenyl)ethylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[1-(4-ethylphenyl)ethylamino]-3-(2-thienyl)propanoic acid CAS Name: 3-[1-(4-ethylphenyl)ethylamino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[1-(4-ethylphenyl)ethylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[1-(4-ethylphenyl)ethylamino]-3-(2-thienyl)propionic acid Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

CCC1=CC=C(C=C1)C(C)NC(CC(=O)O)C2=CC=CS2

InChI

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