[2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-piperidin-1-ylphenyl)methyl]azanium

Systemtic Name: [2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2-piperidin-1-ylphenyl)methyl]azanium Openeye Name: [2-(4-cyanoanilino)-2-oxo-ethyl]-methyl-[[2-(1-piperidyl)phenyl]methyl]ammonium CAS Name: [2-(4-cyanoanilino)-2-oxoethyl]-methyl-[[2-(1-piperidinyl)phenyl]methyl]ammonium IUPAC Name: [2-(4-cyanoanilino)-2-oxoethyl]-methyl-[(2-piperidin-1-ylphenyl)methyl]azanium Traditional Name: [2-(4-cyanoanilino)-2-keto-ethyl]-methyl-(2-piperidinobenzyl)ammonium Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1N2CCCCC2)CC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C[NH+](CC1=CC=CC=C1N2CCCCC2)CC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H26N4O/c1-25(17-22(27)24-20-11-9-18(15-23)10-12-20)16-19-7-3-4-8-21(19)26-13-5-2-6-14-26/h3-4,7-12H,2,5-6,13-14,16-17H2,1H3,(H,24,27)/p+1