8-bromanyl-3-(3-oxidanylpropyl)-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 8-bromanyl-3-(3-oxidanylpropyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 8-bromo-3-(3-hydroxypropyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 8-bromo-3-(3-hydroxypropyl)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 8-bromo-3-(3-hydroxypropyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 8-bromo-3-(3-hydroxypropyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C13H12BrN3O2 MolecularWeight: 322.15728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C3=C(N2)C(=O)N(C=N3)CCCO

Isomeric SMILES

C1=CC2=C(C=C1Br)C3=C(N2)C(=O)N(C=N3)CCCO

InChI

InChI=1S/C13H12BrN3O2/c14-8-2-3-10-9(6-8)11-12(16-10)13(19)17(7-15-11)4-1-5-18/h2-3,6-7,16,18H,1,4-5H2