3-[(2-methylcyclohexyl)amino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[(2-methylcyclohexyl)amino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[(2-methylcyclohexyl)amino]-3-(2-thienyl)propanoic acid CAS Name: 3-[(2-methylcyclohexyl)amino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[(2-methylcyclohexyl)amino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[(2-methylcyclohexyl)amino]-3-(2-thienyl)propionic acid Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

CC1CCCCC1NC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C14H21NO2S/c1-10-5-2-3-6-11(10)15-12(9-14(16)17)13-7-4-8-18-13/h4,7-8,10-12,15H,2-3,5-6,9H2,1H3,(H,16,17)