4-methyl-1-(4-thiophen-2-ylbutanoylamino)cyclohexane-1-carboxylic acid

Systemtic Name: 4-methyl-1-(4-thiophen-2-ylbutanoylamino)cyclohexane-1-carboxylic acid Openeye Name: 4-methyl-1-[4-(2-thienyl)butanoylamino]cyclohexanecarboxylic acid CAS Name: 4-methyl-1-[(1-oxo-4-thiophen-2-ylbutyl)amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-methyl-1-(4-thiophen-2-ylbutanoylamino)cyclohexane-1-carboxylic acid Traditional Name: 4-methyl-1-[4-(2-thienyl)butanoylamino]cyclohexanecarboxylic acid Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(=O)O)NC(=O)CCCC2=CC=CS2

Isomeric SMILES

CC1CCC(CC1)(C(=O)O)NC(=O)CCCC2=CC=CS2

InChI

InChI=1S/C16H23NO3S/c1-12-7-9-16(10-8-12,15(19)20)17-14(18)6-2-4-13-5-3-11-21-13/h3,5,11-12H,2,4,6-10H2,1H3,(H,17,18)(H,19,20)