1-[2-(4-methoxy-2-methyl-phenyl)propanoylamino]-3-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-(4-methoxy-2-methyl-phenyl)propanoylamino]-3-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(4-methoxy-2-methyl-phenyl)propanoylamino]-3-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[2-(4-methoxy-2-methylphenyl)-1-oxopropyl]amino]-3-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(4-methoxy-2-methylphenyl)propanoylamino]-3-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[2-(4-methoxy-2-methyl-phenyl)propanoylamino]-3-methyl-cyclohexanecarboxylic acid Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)(C(=O)O)NC(=O)C(C)C2=C(C=C(C=C2)OC)C

Isomeric SMILES

CC1CCCC(C1)(C(=O)O)NC(=O)C(C)C2=C(C=C(C=C2)OC)C

InChI

InChI=1S/C19H27NO4/c1-12-6-5-9-19(11-12,18(22)23)20-17(21)14(3)16-8-7-15(24-4)10-13(16)2/h7-8,10,12,14H,5-6,9,11H2,1-4H3,(H,20,21)(H,22,23)