methyl-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(2-piperidin-1-ylphenyl)methyl]azanium

Systemtic Name: methyl-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(2-piperidin-1-ylphenyl)methyl]azanium Openeye Name: methyl-[2-(3-methylanilino)-2-oxo-ethyl]-[[2-(1-piperidyl)phenyl]methyl]ammonium CAS Name: methyl-[2-(3-methylanilino)-2-oxoethyl]-[[2-(1-piperidinyl)phenyl]methyl]ammonium IUPAC Name: methyl-[2-(3-methylanilino)-2-oxoethyl]-[(2-piperidin-1-ylphenyl)methyl]azanium Traditional Name: [2-keto-2-(m-toluidino)ethyl]-methyl-(2-piperidinobenzyl)ammonium Formula: C22H30N3O+ MolecularWeight: 352.4931

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O/c1-18-9-8-11-20(15-18)23-22(26)17-24(2)16-19-10-4-5-12-21(19)25-13-6-3-7-14-25/h4-5,8-12,15H,3,6-7,13-14,16-17H2,1-2H3,(H,23,26)/p+1