3-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-7,8-dimethoxy-5H-pyrimid[5,4-b]indol-4-one Formula: C19H15BrN4O4 MolecularWeight: 443.2508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=C(N2)C(=O)N(C=N3)NC=C4C=C(C=CC4=O)Br)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=C(N2)C(=O)N(C=N3)NC=C4C=C(C=CC4=O)Br)OC

InChI

InChI=1S/C19H15BrN4O4/c1-27-15-6-12-13(7-16(15)28-2)23-18-17(12)21-9-24(19(18)26)22-8-10-5-11(20)3-4-14(10)25/h3-9,22-23H,1-2H3