3-methyl-4-[(5-methyl-2-propan-2-yl-cyclohexyl)amino]benzoic acid

Systemtic Name: 3-methyl-4-[(5-methyl-2-propan-2-yl-cyclohexyl)amino]benzoic acid Openeye Name: 4-[(2-isopropyl-5-methyl-cyclohexyl)amino]-3-methyl-benzoic acid CAS Name: 3-methyl-4-[(5-methyl-2-propan-2-ylcyclohexyl)amino]benzoic acid IUPAC Name: 3-methyl-4-[(5-methyl-2-propan-2-ylcyclohexyl)amino]benzoic acid Traditional Name: 4-[(2-isopropyl-5-methyl-cyclohexyl)amino]-3-methyl-benzoic acid Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)NC2=C(C=C(C=C2)C(=O)O)C)C(C)C

Isomeric SMILES

CC1CCC(C(C1)NC2=C(C=C(C=C2)C(=O)O)C)C(C)C

InChI

InChI=1S/C18H27NO2/c1-11(2)15-7-5-12(3)9-17(15)19-16-8-6-14(18(20)21)10-13(16)4/h6,8,10-12,15,17,19H,5,7,9H2,1-4H3,(H,20,21)