3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[(E)-piperonylideneamino]-5H-pyrimid[5,4-b]indol-4-one Formula: C18H12N4O3 MolecularWeight: 332.31288

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NN3C=NC4=C(C3=O)NC5=CC=CC=C54

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/N3C=NC4=C(C3=O)NC5=CC=CC=C54

InChI

InChI=1S/C18H12N4O3/c23-18-17-16(12-3-1-2-4-13(12)21-17)19-9-22(18)20-8-11-5-6-14-15(7-11)25-10-24-14/h1-9,21H,10H2/b20-8+