[2-[(2-cyanophenyl)methyl]-3H-isoindol-2-ium-1-yl]azanium

Systemtic Name: [2-[(2-cyanophenyl)methyl]-3H-isoindol-2-ium-1-yl]azanium Openeye Name: [2-[(2-cyanophenyl)methyl]-3H-isoindol-2-ium-1-yl]ammonium CAS Name: [2-[(2-cyanophenyl)methyl]-3H-isoindol-2-ium-1-yl]ammonium IUPAC Name: [2-[(2-cyanophenyl)methyl]-3H-isoindol-2-ium-1-yl]azanium Traditional Name: [2-(2-cyanobenzyl)-3H-isoindol-2-ium-1-yl]ammonium Formula: C16H15N3+2 MolecularWeight: 249.3104

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=[N+]1CC3=CC=CC=C3C#N)[NH3+]

Isomeric SMILES

C1C2=CC=CC=C2C(=[N+]1CC3=CC=CC=C3C#N)[NH3+]

InChI

InChI=1S/C16H13N3/c17-9-12-5-1-2-6-13(12)10-19-11-14-7-3-4-8-15(14)16(19)18/h1-8,18H,10-11H2/p+2