2-(4-ethylpiperazin-4-ium-1-yl)-7,8-dimethyl-quinolin-1-ium-3-carbaldehyde

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)-7,8-dimethyl-quinolin-1-ium-3-carbaldehyde Openeye Name: 2-(4-ethylpiperazin-4-ium-1-yl)-7,8-dimethyl-quinolin-1-ium-3-carbaldehyde CAS Name: 2-(4-ethyl-1-piperazin-4-iumyl)-7,8-dimethyl-3-quinolin-1-iumcarboxaldehyde IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-yl)-7,8-dimethylquinolin-1-ium-3-carbaldehyde Traditional Name: 2-(4-ethylpiperazin-4-ium-1-yl)-7,8-dimethyl-quinolin-1-ium-3-carbaldehyde Formula: C18H25N3O+2 MolecularWeight: 299.4106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O/c1-4-20-7-9-21(10-8-20)18-16(12-22)11-15-6-5-13(2)14(3)17(15)19-18/h5-6,11-12H,4,7-10H2,1-3H3/p+2