3-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-7-methoxy-1,5-dihydropyrimido[5,4-b]indole-2,4-dione

Systemtic Name: 3-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-7-methoxy-1,5-dihydropyrimido[5,4-b]indole-2,4-dione Openeye Name: 3-[(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-7-methoxy-1,5-dihydropyrimido[5,4-b]indole-2,4-dione CAS Name: 3-[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-7-methoxy-1,5-dihydropyrimido[5,4-b]indole-2,4-dione IUPAC Name: 3-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-7-methoxy-1,5-dihydropyrimido[5,4-b]indole-2,4-dione Traditional Name: 3-[(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-7-methoxy-1,5-dihydropyrimid[5,4-b]indole-2,4-quinone Formula: C18H13BrN4O4 MolecularWeight: 429.22422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(N2)C(=O)N(C(=O)N3)NC=C4C=C(C=CC4=O)Br

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(N2)C(=O)N(C(=O)N3)NC=C4C=C(C=CC4=O)Br

InChI

InChI=1S/C18H13BrN4O4/c1-27-11-3-4-12-13(7-11)21-16-15(12)22-18(26)23(17(16)25)20-8-9-6-10(19)2-5-14(9)24/h2-8,20-21H,1H3,(H,22,26)