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

Systemtic Name: 8-methoxy-5-methyl-3-(2-piperazin-4-ium-1-ylethyl)pyrimido[5,4-b]indol-4-one Openeye Name: 8-methoxy-5-methyl-3-(2-piperazin-4-ium-1-ylethyl)pyrimido[5,4-b]indol-4-one CAS Name: 8-methoxy-5-methyl-3-[2-(1-piperazin-4-iumyl)ethyl]-4-pyrimido[5,4-b]indolone IUPAC Name: 8-methoxy-5-methyl-3-(2-piperazin-4-ium-1-ylethyl)pyrimido[5,4-b]indol-4-one Traditional Name: 8-methoxy-5-methyl-3-(2-piperazin-4-ium-1-ylethyl)pyrimid[5,4-b]indol-4-one Formula: C18H24N5O2+ MolecularWeight: 342.41546

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C=N3)CCN4CC[NH2+]CC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C3=C1C(=O)N(C=N3)CCN4CC[NH2+]CC4

InChI

InChI=1S/C18H23N5O2/c1-21-15-4-3-13(25-2)11-14(15)16-17(21)18(24)23(12-20-16)10-9-22-7-5-19-6-8-22/h3-4,11-12,19H,5-10H2,1-2H3/p+1