3-thiophen-2-yl-3-[(3,3,5-trimethylcyclohexyl)amino]propanoic acid

Systemtic Name: 3-thiophen-2-yl-3-[(3,3,5-trimethylcyclohexyl)amino]propanoic acid Openeye Name: 3-(2-thienyl)-3-[(3,3,5-trimethylcyclohexyl)amino]propanoic acid CAS Name: 3-thiophen-2-yl-3-[(3,3,5-trimethylcyclohexyl)amino]propanoic acid IUPAC Name: 3-thiophen-2-yl-3-[(3,3,5-trimethylcyclohexyl)amino]propanoic acid Traditional Name: 3-(2-thienyl)-3-[(3,3,5-trimethylcyclohexyl)amino]propionic acid Formula: C16H25NO2S MolecularWeight: 295.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)NC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

CC1CC(CC(C1)(C)C)NC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C16H25NO2S/c1-11-7-12(10-16(2,3)9-11)17-13(8-15(18)19)14-5-4-6-20-14/h4-6,11-13,17H,7-10H2,1-3H3,(H,18,19)