4-[(E)-[1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[(E)-[1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(E)-(1,3-dioxo-4-isoquinolylidene)methyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(E)-(1,3-dioxo-4-isoquinolinylidene)methyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(E)-(1,3-dioxoisoquinolin-4-ylidene)methyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(E)-(1,3-diketo-4-isoquinolylidene)methyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C17H13N3O2 MolecularWeight: 291.30402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)C=C2C3=CC=CC=C3C(=O)NC2=O

Isomeric SMILES

CC1=C(C=C(N1C)C#N)/C=C/2\C3=CC=CC=C3C(=O)NC2=O

InChI

InChI=1S/C17H13N3O2/c1-10-11(7-12(9-18)20(10)2)8-15-13-5-3-4-6-14(13)16(21)19-17(15)22/h3-8H,1-2H3,(H,19,21,22)/b15-8+