2-[2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-5-methyl-pyrrol-1-yl]ethanenitrile

Systemtic Name: 2-[2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-5-methyl-pyrrol-1-yl]ethanenitrile Openeye Name: 2-[2-[(1,3-dioxoisoindolin-2-yl)methyl]-5-methyl-pyrrol-1-yl]acetonitrile CAS Name: 2-[2-[(1,3-dioxo-2-isoindolyl)methyl]-5-methyl-1-pyrrolyl]acetonitrile IUPAC Name: 2-[2-[(1,3-dioxoisoindol-2-yl)methyl]-5-methylpyrrol-1-yl]acetonitrile Traditional Name: 2-[2-methyl-5-(phthalimidomethyl)pyrrol-1-yl]acetonitrile Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1CC#N)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(N1CC#N)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H13N3O2/c1-11-6-7-12(18(11)9-8-17)10-19-15(20)13-4-2-3-5-14(13)16(19)21/h2-7H,9-10H2,1H3