methyl 1-(3-thiophen-3-ylpropanoylamino)cyclohexane-1-carboxylate

Systemtic Name: methyl 1-(3-thiophen-3-ylpropanoylamino)cyclohexane-1-carboxylate Openeye Name: methyl 1-[3-(3-thienyl)propanoylamino]cyclohexanecarboxylate CAS Name: 1-[[1-oxo-3-(3-thiophenyl)propyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-thiophen-3-ylpropanoylamino)cyclohexane-1-carboxylate Traditional Name: 1-[3-(3-thienyl)propanoylamino]cyclohexanecarboxylic acid methyl ester Formula: C15H21NO3S MolecularWeight: 295.39714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)CCC2=CSC=C2

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)CCC2=CSC=C2

InChI

InChI=1S/C15H21NO3S/c1-19-14(18)15(8-3-2-4-9-15)16-13(17)6-5-12-7-10-20-11-12/h7,10-11H,2-6,8-9H2,1H3,(H,16,17)