[1-(2-cyanophenyl)pyrrol-2-yl]methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [1-(2-cyanophenyl)pyrrol-2-yl]methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [1-(2-cyanophenyl)pyrrol-2-yl]methyl-(p-tolylmethyl)ammonium CAS Name: [1-(2-cyanophenyl)-2-pyrrolyl]methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [1-(2-cyanophenyl)pyrrol-2-yl]methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [1-(2-cyanophenyl)pyrrol-2-yl]methyl-(4-methylbenzyl)ammonium Formula: C20H20N3+ MolecularWeight: 302.3929

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]CC2=CC=CN2C3=CC=CC=C3C#N

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+]CC2=CC=CN2C3=CC=CC=C3C#N

InChI

InChI=1S/C20H19N3/c1-16-8-10-17(11-9-16)14-22-15-19-6-4-12-23(19)20-7-3-2-5-18(20)13-21/h2-12,22H,14-15H2,1H3/p+1