2-(4-ethylpiperazin-4-ium-1-yl)-6-methoxy-quinoline-3-carbaldehyde

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-methoxy-quinoline-3-carbaldehyde Openeye Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-methoxy-quinoline-3-carbaldehyde CAS Name: 2-(4-ethyl-1-piperazin-4-iumyl)-6-methoxy-3-quinolinecarboxaldehyde IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-methoxyquinoline-3-carbaldehyde Traditional Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-methoxy-quinoline-3-carbaldehyde Formula: C17H22N3O2+ MolecularWeight: 300.37548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)OC)C=O

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C3C=C(C=CC3=N2)OC)C=O

InChI

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