2-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[(3-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[(3-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-[(3-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[(3-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-[(3-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C20H12BrN3O6 MolecularWeight: 470.22978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNN2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O)C=C(C1=O)Br

Isomeric SMILES

COC1=CC(=CNN2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O)C=C(C1=O)Br

InChI

InChI=1S/C20H12BrN3O6/c1-30-16-8-10(7-14(21)18(16)25)9-22-23-19(26)12-4-2-3-11-15(24(28)29)6-5-13(17(11)12)20(23)27/h2-9,22H,1H3