[(2R)-1-oxidanylbutan-2-yl]-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: [(2R)-1-oxidanylbutan-2-yl]-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: [(2R)-1-hydroxybutan-2-yl]-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-[(1R)-1-methylolpropyl]ammonium Formula: C16H28N2O+2 MolecularWeight: 264.40632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]C1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CC[C@H](CO)[NH2+]C1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H26N2O/c1-2-15(13-19)17-16-8-10-18(11-9-16)12-14-6-4-3-5-7-14/h3-7,15-17,19H,2,8-13H2,1H3/p+2/t15-/m1/s1