2-[1,3-bis(oxidanylidene)isoindol-2-yl]-1,4,5-trimethyl-pyrrole-3-carbonitrile

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-1,4,5-trimethyl-pyrrole-3-carbonitrile Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-1,4,5-trimethyl-pyrrole-3-carbonitrile CAS Name: 2-(1,3-dioxo-2-isoindolyl)-1,4,5-trimethyl-3-pyrrolecarbonitrile IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-1,4,5-trimethylpyrrole-3-carbonitrile Traditional Name: 1,4,5-trimethyl-2-phthalimido-pyrrole-3-carbonitrile Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)N2C(=O)C3=CC=CC=C3C2=O)C)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)N2C(=O)C3=CC=CC=C3C2=O)C)C

InChI

InChI=1S/C16H13N3O2/c1-9-10(2)18(3)14(13(9)8-17)19-15(20)11-6-4-5-7-12(11)16(19)21/h4-7H,1-3H3