[1-(2-cyanophenyl)pyrrol-2-yl]methyl-(2-dimethylaminoethyl)-(phenylmethyl)azanium

Systemtic Name: [1-(2-cyanophenyl)pyrrol-2-yl]methyl-(2-dimethylaminoethyl)-(phenylmethyl)azanium Openeye Name: benzyl-[[1-(2-cyanophenyl)pyrrol-2-yl]methyl]-(2-dimethylaminoethyl)ammonium CAS Name: [1-(2-cyanophenyl)-2-pyrrolyl]methyl-(2-dimethylaminoethyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-[[1-(2-cyanophenyl)pyrrol-2-yl]methyl]-(2-dimethylaminoethyl)azanium Traditional Name: benzyl-[[1-(2-cyanophenyl)pyrrol-2-yl]methyl]-(2-dimethylaminoethyl)ammonium Formula: C23H27N4+ MolecularWeight: 359.48728

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC[NH+](CC1=CC=CC=C1)CC2=CC=CN2C3=CC=CC=C3C#N

Isomeric SMILES

CN(C)CC[NH+](CC1=CC=CC=C1)CC2=CC=CN2C3=CC=CC=C3C#N

InChI

InChI=1S/C23H26N4/c1-25(2)15-16-26(18-20-9-4-3-5-10-20)19-22-12-8-14-27(22)23-13-7-6-11-21(23)17-24/h3-14H,15-16,18-19H2,1-2H3/p+1