(4-dimethylaminophenyl)methyl-ethyl-[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-ethyl-[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl]azanium Openeye Name: [2-(2-benzylanilino)-2-oxo-ethyl]-[(4-dimethylaminophenyl)methyl]-ethyl-ammonium CAS Name: (4-dimethylaminophenyl)methyl-ethyl-[2-oxo-2-[2-(phenylmethyl)anilino]ethyl]ammonium IUPAC Name: [2-(2-benzylanilino)-2-oxoethyl]-[(4-dimethylaminophenyl)methyl]-ethylazanium Traditional Name: [2-(2-benzylanilino)-2-keto-ethyl]-[4-(dimethylamino)benzyl]-ethyl-ammonium Formula: C26H32N3O+ MolecularWeight: 402.55178

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(C=C1)N(C)C)CC(=O)NC2=CC=CC=C2CC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC1=CC=C(C=C1)N(C)C)CC(=O)NC2=CC=CC=C2CC3=CC=CC=C3

InChI

InChI=1S/C26H31N3O/c1-4-29(19-22-14-16-24(17-15-22)28(2)3)20-26(30)27-25-13-9-8-12-23(25)18-21-10-6-5-7-11-21/h5-17H,4,18-20H2,1-3H3,(H,27,30)/p+1