cyclohexanamine; 2-[3-(4-methylphenyl)cyclohexyl]ethanoic acid

Systemtic Name: cyclohexanamine; 2-[3-(4-methylphenyl)cyclohexyl]ethanoic acid Openeye Name: cyclohexanamine; 2-[3-(p-tolyl)cyclohexyl]acetic acid CAS Name: cyclohexanamine; 2-[3-(4-methylphenyl)cyclohexyl]acetic acid IUPAC Name: cyclohexanamine; 2-[3-(4-methylphenyl)cyclohexyl]acetic acid Traditional Name: cyclohexylamine; 2-[3-(p-tolyl)cyclohexyl]acetic acid Formula: C21H33NO2 MolecularWeight: 331.49222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCCC(C2)CC(=O)O.C1CCC(CC1)N

Isomeric SMILES

CC1=CC=C(C=C1)C2CCCC(C2)CC(=O)O.C1CCC(CC1)N

InChI

InChI=1S/C15H20O2.C6H13N/c1-11-5-7-13(8-6-11)14-4-2-3-12(9-14)10-15(16)17;7-6-4-2-1-3-5-6/h5-8,12,14H,2-4,9-10H2,1H3,(H,16,17);6H,1-5,7H2