cyclohexanamine; 2-[4-(phenylmethyl)phenyl]propanoic acid

Systemtic Name: cyclohexanamine; 2-[4-(phenylmethyl)phenyl]propanoic acid Openeye Name: 2-(4-benzylphenyl)propanoic acid; cyclohexanamine CAS Name: cyclohexanamine; 2-[4-(phenylmethyl)phenyl]propanoic acid IUPAC Name: 2-(4-benzylphenyl)propanoic acid; cyclohexanamine Traditional Name: 2-(4-benzylphenyl)propionic acid; cyclohexylamine Formula: C22H29NO2 MolecularWeight: 339.47116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)CC2=CC=CC=C2)C(=O)O.C1CCC(CC1)N

Isomeric SMILES

CC(C1=CC=C(C=C1)CC2=CC=CC=C2)C(=O)O.C1CCC(CC1)N

InChI

InChI=1S/C16H16O2.C6H13N/c1-12(16(17)18)15-9-7-14(8-10-15)11-13-5-3-2-4-6-13;7-6-4-2-1-3-5-6/h2-10,12H,11H2,1H3,(H,17,18);6H,1-5,7H2