(4E)-2-(1,3-benzodioxol-5-ylmethyl)-4-(pyridin-3-ylmethylidene)isoquinoline-1,3-dione

Systemtic Name: (4E)-2-(1,3-benzodioxol-5-ylmethyl)-4-(pyridin-3-ylmethylidene)isoquinoline-1,3-dione Openeye Name: (4E)-2-(1,3-benzodioxol-5-ylmethyl)-4-(3-pyridylmethylene)isoquinoline-1,3-dione CAS Name: (4E)-2-(1,3-benzodioxol-5-ylmethyl)-4-(3-pyridinylmethylidene)isoquinoline-1,3-dione IUPAC Name: (4E)-2-(1,3-benzodioxol-5-ylmethyl)-4-(pyridin-3-ylmethylidene)isoquinoline-1,3-dione Traditional Name: (4E)-2-piperonyl-4-(3-pyridylmethylene)isoquinoline-1,3-quinone Formula: C23H16N2O4 MolecularWeight: 384.38414

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4C(=CC5=CN=CC=C5)C3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4/C(=C\C5=CN=CC=C5)/C3=O

InChI

InChI=1S/C23H16N2O4/c26-22-18-6-2-1-5-17(18)19(10-15-4-3-9-24-12-15)23(27)25(22)13-16-7-8-20-21(11-16)29-14-28-20/h1-12H,13-14H2/b19-10+