[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-piperidin-1-ylphenyl)methyl]azanium

Systemtic Name: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-piperidin-1-ylphenyl)methyl]azanium Openeye Name: [2-(2,6-dimethylanilino)-2-oxo-ethyl]-methyl-[[2-(1-piperidyl)phenyl]methyl]ammonium CAS Name: [2-(2,6-dimethylanilino)-2-oxoethyl]-methyl-[[2-(1-piperidinyl)phenyl]methyl]ammonium IUPAC Name: [2-(2,6-dimethylanilino)-2-oxoethyl]-methyl-[(2-piperidin-1-ylphenyl)methyl]azanium Traditional Name: [2-(2,6-dimethylanilino)-2-keto-ethyl]-methyl-(2-piperidinobenzyl)ammonium Formula: C23H32N3O+ MolecularWeight: 366.51968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](C)CC2=CC=CC=C2N3CCCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](C)CC2=CC=CC=C2N3CCCCC3

InChI

InChI=1S/C23H31N3O/c1-18-10-9-11-19(2)23(18)24-22(27)17-25(3)16-20-12-5-6-13-21(20)26-14-7-4-8-15-26/h5-6,9-13H,4,7-8,14-17H2,1-3H3,(H,24,27)/p+1