5-methyl-2-[(2-oxidanyl-1-propan-2-yl-cyclohexyl)amino]benzoate

Systemtic Name: 5-methyl-2-[(2-oxidanyl-1-propan-2-yl-cyclohexyl)amino]benzoate Openeye Name: 2-[(2-hydroxy-1-isopropyl-cyclohexyl)amino]-5-methyl-benzoate CAS Name: 2-[(2-hydroxy-1-propan-2-ylcyclohexyl)amino]-5-methylbenzoate IUPAC Name: 2-[(2-hydroxy-1-propan-2-ylcyclohexyl)amino]-5-methylbenzoate Traditional Name: 2-[(2-hydroxy-1-isopropyl-cyclohexyl)amino]-5-methyl-benzoate Formula: C17H24NO3- MolecularWeight: 290.37736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2(CCCCC2O)C(C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC2(CCCCC2O)C(C)C)C(=O)[O-]

InChI

InChI=1S/C17H25NO3/c1-11(2)17(9-5-4-6-15(17)19)18-14-8-7-12(3)10-13(14)16(20)21/h7-8,10-11,15,18-19H,4-6,9H2,1-3H3,(H,20,21)/p-1