ethanamide; 3-[4-(4-methylcyclohexyl)carbonylphenyl]propanoic acid

Systemtic Name: ethanamide; 3-[4-(4-methylcyclohexyl)carbonylphenyl]propanoic acid Openeye Name: acetamide; 3-[4-(4-methylcyclohexanecarbonyl)phenyl]propanoic acid CAS Name: acetamide; 3-[4-[(4-methylcyclohexyl)-oxomethyl]phenyl]propanoic acid IUPAC Name: acetamide; 3-[4-(4-methylcyclohexanecarbonyl)phenyl]propanoic acid Traditional Name: acetamide; 3-[4-(4-methylcyclohexanecarbonyl)phenyl]propionic acid Formula: C19H27NO4 MolecularWeight: 333.42198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)C2=CC=C(C=C2)CCC(=O)O.CC(=O)N

Isomeric SMILES

CC1CCC(CC1)C(=O)C2=CC=C(C=C2)CCC(=O)O.CC(=O)N

InChI

InChI=1S/C17H22O3.C2H5NO/c1-12-2-7-14(8-3-12)17(20)15-9-4-13(5-10-15)6-11-16(18)19;1-2(3)4/h4-5,9-10,12,14H,2-3,6-8,11H2,1H3,(H,18,19);1H3,(H2,3,4)