5-[4-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one

Systemtic Name: 5-[4-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one Openeye Name: 5-[4-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one CAS Name: 5-[4-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]-1-piperazin-4-iumyl]-2-methyl-3-pyridazinone IUPAC Name: 5-[4-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]piperazin-4-ium-1-yl]-2-methylpyridazin-3-one Traditional Name: 5-[4-[(5-methoxy-3-methyl-1H-indol-2-yl)methyl]piperazin-4-ium-1-yl]-2-methyl-pyridazin-3-one Formula: C20H26N5O2+ MolecularWeight: 368.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)OC)C[NH+]3CCN(CC3)C4=CC(=O)N(N=C4)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)OC)C[NH+]3CCN(CC3)C4=CC(=O)N(N=C4)C

InChI

InChI=1S/C20H25N5O2/c1-14-17-11-16(27-3)4-5-18(17)22-19(14)13-24-6-8-25(9-7-24)15-10-20(26)23(2)21-12-15/h4-5,10-12,22H,6-9,13H2,1-3H3/p+1