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

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)-8-methoxy-quinolin-1-ium-3-carbaldehyde Openeye Name: 2-(4-ethylpiperazin-4-ium-1-yl)-8-methoxy-quinolin-1-ium-3-carbaldehyde CAS Name: 2-(4-ethyl-1-piperazin-4-iumyl)-8-methoxy-3-quinolin-1-iumcarboxaldehyde IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-yl)-8-methoxyquinolin-1-ium-3-carbaldehyde Traditional Name: 2-(4-ethylpiperazin-4-ium-1-yl)-8-methoxy-quinolin-1-ium-3-carbaldehyde Formula: C17H23N3O2+2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O2/c1-3-19-7-9-20(10-8-19)17-14(12-21)11-13-5-4-6-15(22-2)16(13)18-17/h4-6,11-12H,3,7-10H2,1-2H3/p+2