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

Systemtic Name: 8-bromanyl-3-(3-morpholin-4-ium-4-ylpropyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 8-bromo-3-(3-morpholin-4-ium-4-ylpropyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 8-bromo-3-[3-(4-morpholin-4-iumyl)propyl]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 8-bromo-3-(3-morpholin-4-ium-4-ylpropyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 8-bromo-3-(3-morpholin-4-ium-4-ylpropyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C17H20BrN4O2+ MolecularWeight: 392.2703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)Br

Isomeric SMILES

C1COCC[NH+]1CCCN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)Br

InChI

InChI=1S/C17H19BrN4O2/c18-12-2-3-14-13(10-12)15-16(20-14)17(23)22(11-19-15)5-1-4-21-6-8-24-9-7-21/h2-3,10-11,20H,1,4-9H2/p+1