methyl 2-(8-bromanyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethanoate

Systemtic Name: methyl 2-(8-bromanyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethanoate Openeye Name: methyl 2-(8-bromo-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetate CAS Name: 2-(8-bromo-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetic acid methyl ester IUPAC Name: methyl 2-(8-bromo-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetate Traditional Name: 2-(8-bromo-4-keto-5H-pyrimid[5,4-b]indol-3-yl)acetic acid methyl ester Formula: C13H10BrN3O3 MolecularWeight: 336.1408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C=NC2=C(C1=O)NC3=C2C=C(C=C3)Br

Isomeric SMILES

COC(=O)CN1C=NC2=C(C1=O)NC3=C2C=C(C=C3)Br

InChI

InChI=1S/C13H10BrN3O3/c1-20-10(18)5-17-6-15-11-8-4-7(14)2-3-9(8)16-12(11)13(17)19/h2-4,6,16H,5H2,1H3