8-methoxy-5-methyl-3-(2-piperidin-1-ium-1-ylethyl)pyrimido[5,4-b]indol-4-one

Systemtic Name: 8-methoxy-5-methyl-3-(2-piperidin-1-ium-1-ylethyl)pyrimido[5,4-b]indol-4-one Openeye Name: 8-methoxy-5-methyl-3-(2-piperidin-1-ium-1-ylethyl)pyrimido[5,4-b]indol-4-one CAS Name: 8-methoxy-5-methyl-3-[2-(1-piperidin-1-iumyl)ethyl]-4-pyrimido[5,4-b]indolone IUPAC Name: 8-methoxy-5-methyl-3-(2-piperidin-1-ium-1-ylethyl)pyrimido[5,4-b]indol-4-one Traditional Name: 8-methoxy-5-methyl-3-(2-piperidin-1-ium-1-ylethyl)pyrimid[5,4-b]indol-4-one Formula: C19H25N4O2+ MolecularWeight: 341.4274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C=N3)CC[NH+]4CCCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C=N3)CC[NH+]4CCCCC4

InChI

InChI=1S/C19H24N4O2/c1-21-16-7-6-14(25-2)12-15(16)17-18(21)19(24)23(13-20-17)11-10-22-8-4-3-5-9-22/h6-7,12-13H,3-5,8-11H2,1-2H3/p+1