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

Systemtic Name: [1-(4-cyanophenyl)pyrrol-2-yl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[1-(4-cyanophenyl)pyrrol-2-yl]methyl]ammonium CAS Name: [1-(4-cyanophenyl)-2-pyrrolyl]methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[1-(4-cyanophenyl)pyrrol-2-yl]methyl]azanium Traditional Name: benzyl-[[1-(4-cyanophenyl)pyrrol-2-yl]methyl]ammonium Formula: C19H18N3+ MolecularWeight: 288.36632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]CC2=CC=CN2C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+]CC2=CC=CN2C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H17N3/c20-13-16-8-10-18(11-9-16)22-12-4-7-19(22)15-21-14-17-5-2-1-3-6-17/h1-12,21H,14-15H2/p+1