2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino)-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino)-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino)-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino)-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino)-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino)-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C21H13N3O6 MolecularWeight: 403.34442

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C=NN3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C=NN3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O

InChI

InChI=1S/C21H13N3O6/c25-20-14-3-1-2-13-16(24(27)28)6-5-15(19(13)14)21(26)23(20)22-11-12-4-7-17-18(10-12)30-9-8-29-17/h1-7,10-11H,8-9H2