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

Systemtic Name: methyl 3-[[(1R,2R)-2-[(phenylmethyl)amino]cyclohexyl]amino]propanoate Openeye Name: methyl 3-[[(1R,2R)-2-(benzylamino)cyclohexyl]amino]propanoate CAS Name: 3-[[(1R,2R)-2-[(phenylmethyl)amino]cyclohexyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[(1R,2R)-2-(benzylamino)cyclohexyl]amino]propanoate Traditional Name: 3-[[(1R,2R)-2-(benzylamino)cyclohexyl]amino]propionic acid methyl ester Formula: C17H26N2O2 MolecularWeight: 290.40054

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC1CCCCC1NCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCN[C@@H]1CCCC[C@H]1NCC2=CC=CC=C2

InChI

InChI=1S/C17H26N2O2/c1-21-17(20)11-12-18-15-9-5-6-10-16(15)19-13-14-7-3-2-4-8-14/h2-4,7-8,15-16,18-19H,5-6,9-13H2,1H3/t15-,16-/m1/s1