8-methyl-3-(2-morpholin-4-ium-4-ylethyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one

Systemtic Name: 8-methyl-3-(2-morpholin-4-ium-4-ylethyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one Openeye Name: 8-methyl-3-(2-morpholin-4-ium-4-ylethyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one CAS Name: 8-methyl-3-[2-(4-morpholin-4-iumyl)ethyl]-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one IUPAC Name: 8-methyl-3-(2-morpholin-4-ium-4-ylethyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one Traditional Name: 8-methyl-3-(2-morpholin-4-ium-4-ylethyl)-1,5-dihydropyrimid[5,4-b]indol-3-ium-4-one Formula: C17H22N4O2+2 MolecularWeight: 314.38218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC3=C2NC=[N+](C3=O)CC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC2=C(C=C1)NC3=C2NC=[N+](C3=O)CC[NH+]4CCOCC4

InChI

InChI=1S/C17H20N4O2/c1-12-2-3-14-13(10-12)15-16(19-14)17(22)21(11-18-15)5-4-20-6-8-23-9-7-20/h2-3,10-11H,4-9H2,1H3,(H,19,22)/p+2