methyl 3-[(2,6-dimethylcyclohexyl)amino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[(2,6-dimethylcyclohexyl)amino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[(2,6-dimethylcyclohexyl)amino]-3-(2-thienyl)propanoate CAS Name: 3-[(2,6-dimethylcyclohexyl)amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[(2,6-dimethylcyclohexyl)amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[(2,6-dimethylcyclohexyl)amino]-3-(2-thienyl)propionic acid methyl ester Formula: C16H25NO2S MolecularWeight: 295.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1NC(CC(=O)OC)C2=CC=CS2)C

Isomeric SMILES

CC1CCCC(C1NC(CC(=O)OC)C2=CC=CS2)C

InChI

InChI=1S/C16H25NO2S/c1-11-6-4-7-12(2)16(11)17-13(10-15(18)19-3)14-8-5-9-20-14/h5,8-9,11-13,16-17H,4,6-7,10H2,1-3H3