(4-dimethylaminophenyl)methyl-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[(2R)-1-hydroxybutan-2-yl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(1R)-1-methylolpropyl]ammonium Formula: C13H23N2O+ MolecularWeight: 223.33452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]CC1=CC=C(C=C1)N(C)C

Isomeric SMILES

CC[C@H](CO)[NH2+]CC1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C13H22N2O/c1-4-12(10-16)14-9-11-5-7-13(8-6-11)15(2)3/h5-8,12,14,16H,4,9-10H2,1-3H3/p+1/t12-/m1/s1