[1,3-bis(oxidanylidene)isoindol-2-yl]methyl-(2-cyanoethyl)-(phenylmethyl)azanium

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl-(2-cyanoethyl)-(phenylmethyl)azanium Openeye Name: benzyl-(2-cyanoethyl)-[(1,3-dioxoisoindolin-2-yl)methyl]ammonium CAS Name: 2-cyanoethyl-[(1,3-dioxo-2-isoindolyl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-(2-cyanoethyl)-[(1,3-dioxoisoindol-2-yl)methyl]azanium Traditional Name: benzyl-(2-cyanoethyl)-(phthalimidomethyl)ammonium Formula: C19H18N3O2+ MolecularWeight: 320.36512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CCC#N)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CCC#N)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H17N3O2/c20-11-6-12-21(13-15-7-2-1-3-8-15)14-22-18(23)16-9-4-5-10-17(16)19(22)24/h1-5,7-10H,6,12-14H2/p+1