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

Systemtic Name: 3-[(5-methyl-2-propan-2-yl-cyclohexyl)amino]benzoic acid Openeye Name: 3-[(2-isopropyl-5-methyl-cyclohexyl)amino]benzoic acid CAS Name: 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]benzoic acid IUPAC Name: 3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]benzoic acid Traditional Name: 3-[(2-isopropyl-5-methyl-cyclohexyl)amino]benzoic acid Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO2/c1-11(2)15-8-7-12(3)9-16(15)18-14-6-4-5-13(10-14)17(19)20/h4-6,10-12,15-16,18H,7-9H2,1-3H3,(H,19,20)