methyl-[(4-methylphenyl)methyl]-[(2S)-1-[(4-methylphenyl)methylamino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: methyl-[(4-methylphenyl)methyl]-[(2S)-1-[(4-methylphenyl)methylamino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: methyl-[(1S)-1-methyl-2-oxo-2-(p-tolylmethylamino)ethyl]-(p-tolylmethyl)ammonium CAS Name: methyl-[(4-methylphenyl)methyl]-[(2S)-1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl]ammonium IUPAC Name: methyl-[(4-methylphenyl)methyl]-[(2S)-1-[(4-methylphenyl)methylamino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-[(4-methylbenzyl)amino]ethyl]-methyl-(4-methylbenzyl)ammonium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(C)[NH+](C)CC2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)[C@H](C)[NH+](C)CC2=CC=C(C=C2)C

InChI

InChI=1S/C20H26N2O/c1-15-5-9-18(10-6-15)13-21-20(23)17(3)22(4)14-19-11-7-16(2)8-12-19/h5-12,17H,13-14H2,1-4H3,(H,21,23)/p+1/t17-/m0/s1