2-(1,3-benzodioxol-5-ylmethyl)-4-(1H-pyrrol-2-ylmethylidene)isoquinoline-1,3-dione

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-4-(1H-pyrrol-2-ylmethylidene)isoquinoline-1,3-dione Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-4-(1H-pyrrol-2-ylmethylene)isoquinoline-1,3-dione CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-4-(1H-pyrrol-2-ylmethylidene)isoquinoline-1,3-dione IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-4-(1H-pyrrol-2-ylmethylidene)isoquinoline-1,3-dione Traditional Name: 2-piperonyl-4-(1H-pyrrol-2-ylmethylene)isoquinoline-1,3-quinone Formula: C22H16N2O4 MolecularWeight: 372.37344

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4C(=CC5=CC=CN5)C3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4C(=CC5=CC=CN5)C3=O

InChI

InChI=1S/C22H16N2O4/c25-21-17-6-2-1-5-16(17)18(11-15-4-3-9-23-15)22(26)24(21)12-14-7-8-19-20(10-14)28-13-27-19/h1-11,23H,12-13H2