3-[[(3-methylcyclohexyl)amino]methyl]benzoic acid

Systemtic Name: 3-[[(3-methylcyclohexyl)amino]methyl]benzoic acid Openeye Name: 3-[[(3-methylcyclohexyl)amino]methyl]benzoic acid CAS Name: 3-[[(3-methylcyclohexyl)amino]methyl]benzoic acid IUPAC Name: 3-[[(3-methylcyclohexyl)amino]methyl]benzoic acid Traditional Name: 3-[[(3-methylcyclohexyl)amino]methyl]benzoic acid Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)NCC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1CCCC(C1)NCC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C15H21NO2/c1-11-4-2-7-14(8-11)16-10-12-5-3-6-13(9-12)15(17)18/h3,5-6,9,11,14,16H,2,4,7-8,10H2,1H3,(H,17,18)