6-ethoxy-2-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-carbaldehyde

Systemtic Name: 6-ethoxy-2-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-carbaldehyde Openeye Name: 6-ethoxy-2-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-carbaldehyde CAS Name: 6-ethoxy-2-(4-methyl-1-piperazin-4-iumyl)-3-quinolin-1-iumcarboxaldehyde IUPAC Name: 6-ethoxy-2-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-carbaldehyde Traditional Name: 6-ethoxy-2-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-carbaldehyde Formula: C17H23N3O2+2 MolecularWeight: 301.38342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC(=C([NH+]=C2C=C1)N3CC[NH+](CC3)C)C=O

Isomeric SMILES

CCOC1=CC2=CC(=C([NH+]=C2C=C1)N3CC[NH+](CC3)C)C=O

InChI

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