[(2S)-1-[(2,4-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-(naphthalen-2-ylmethyl)azanium

Systemtic Name: [(2S)-1-[(2,4-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-(naphthalen-2-ylmethyl)azanium Openeye Name: [(1S)-2-(2,4-dimethylanilino)-1-methyl-2-oxo-ethyl]-methyl-(2-naphthylmethyl)ammonium CAS Name: [(2S)-1-(2,4-dimethylanilino)-1-oxopropan-2-yl]-methyl-(2-naphthalenylmethyl)ammonium IUPAC Name: [(2S)-1-(2,4-dimethylanilino)-1-oxopropan-2-yl]-methyl-(naphthalen-2-ylmethyl)azanium Traditional Name: [(1S)-2-(2,4-dimethylanilino)-2-keto-1-methyl-ethyl]-methyl-(2-naphthylmethyl)ammonium Formula: C23H27N2O+ MolecularWeight: 347.47328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)[NH+](C)CC2=CC3=CC=CC=C3C=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@H](C)[NH+](C)CC2=CC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C23H26N2O/c1-16-9-12-22(17(2)13-16)24-23(26)18(3)25(4)15-19-10-11-20-7-5-6-8-21(20)14-19/h5-14,18H,15H2,1-4H3,(H,24,26)/p+1/t18-/m0/s1