7-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)-8-methyl-quinolin-1-ium-3-carbaldehyde

Systemtic Name: 7-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)-8-methyl-quinolin-1-ium-3-carbaldehyde Openeye Name: 7-chloro-2-(4-ethylpiperazin-4-ium-1-yl)-8-methyl-quinolin-1-ium-3-carbaldehyde CAS Name: 7-chloro-2-(4-ethyl-1-piperazin-4-iumyl)-8-methyl-3-quinolin-1-iumcarboxaldehyde IUPAC Name: 7-chloro-2-(4-ethylpiperazin-4-ium-1-yl)-8-methylquinolin-1-ium-3-carbaldehyde Traditional Name: 7-chloro-2-(4-ethylpiperazin-4-ium-1-yl)-8-methyl-quinolin-1-ium-3-carbaldehyde Formula: C17H22ClN3O+2 MolecularWeight: 319.82908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClN3O/c1-3-20-6-8-21(9-7-20)17-14(11-22)10-13-4-5-15(18)12(2)16(13)19-17/h4-5,10-11H,3,6-9H2,1-2H3/p+2