8-bromanyl-3-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione

Systemtic Name: 8-bromanyl-3-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione Openeye Name: 8-bromo-3-[(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione CAS Name: 8-bromo-3-[(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione IUPAC Name: 8-bromo-3-[(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-1,5-dihydropyrimido[5,4-b]indole-2,4-dione Traditional Name: 8-bromo-3-[(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-1,5-dihydropyrimid[5,4-b]indole-2,4-quinone Formula: C17H11BrN4O4 MolecularWeight: 415.19764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C3=C(N2)C(=O)N(C(=O)N3)NC=C4C=CC(=O)C=C4O

Isomeric SMILES

C1=CC2=C(C=C1Br)C3=C(N2)C(=O)N(C(=O)N3)NC=C4C=CC(=O)C=C4O

InChI

InChI=1S/C17H11BrN4O4/c18-9-2-4-12-11(5-9)14-15(20-12)16(25)22(17(26)21-14)19-7-8-1-3-10(23)6-13(8)24/h1-7,19-20,24H,(H,21,26)