8-methoxy-2-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-carbaldehyde

Systemtic Name: 8-methoxy-2-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-carbaldehyde Openeye Name: 8-methoxy-2-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-carbaldehyde CAS Name: 8-methoxy-2-(4-methyl-1-piperazin-4-iumyl)-3-quinolin-1-iumcarboxaldehyde IUPAC Name: 8-methoxy-2-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-carbaldehyde Traditional Name: 8-methoxy-2-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-carbaldehyde Formula: C16H21N3O2+2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C3C=CC=C(C3=[NH+]2)OC)C=O

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C3C=CC=C(C3=[NH+]2)OC)C=O

InChI

InChI=1S/C16H19N3O2/c1-18-6-8-19(9-7-18)16-13(11-20)10-12-4-3-5-14(21-2)15(12)17-16/h3-5,10-11H,6-9H2,1-2H3/p+2