2-[(1R,3R)-3-methyl-1-[[(phenylmethyl)amino]methyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[(1R,3R)-3-methyl-1-[[(phenylmethyl)amino]methyl]cyclohexyl]ethanoic acid Openeye Name: 2-[(1R,3R)-1-[(benzylamino)methyl]-3-methyl-cyclohexyl]acetic acid CAS Name: 2-[(1R,3R)-3-methyl-1-[[(phenylmethyl)amino]methyl]cyclohexyl]acetic acid IUPAC Name: 2-[(1R,3R)-1-[(benzylamino)methyl]-3-methylcyclohexyl]acetic acid Traditional Name: 2-[(1R,3R)-1-[(benzylamino)methyl]-3-methyl-cyclohexyl]acetic acid Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)(CC(=O)O)CNCC2=CC=CC=C2

Isomeric SMILES

C[C@@H]1CCC[C@@](C1)(CC(=O)O)CNCC2=CC=CC=C2

InChI

InChI=1S/C17H25NO2/c1-14-6-5-9-17(10-14,11-16(19)20)13-18-12-15-7-3-2-4-8-15/h2-4,7-8,14,18H,5-6,9-13H2,1H3,(H,19,20)/t14-,17-/m1/s1