[6-ethyl-2-(4-phenylpiperazin-1-yl)quinolin-1-ium-3-yl]methylazanium

Systemtic Name: [6-ethyl-2-(4-phenylpiperazin-1-yl)quinolin-1-ium-3-yl]methylazanium Openeye Name: [6-ethyl-2-(4-phenylpiperazin-1-yl)quinolin-1-ium-3-yl]methylammonium CAS Name: [6-ethyl-2-(4-phenyl-1-piperazinyl)-3-quinolin-1-iumyl]methylammonium IUPAC Name: [6-ethyl-2-(4-phenylpiperazin-1-yl)quinolin-1-ium-3-yl]methylazanium Traditional Name: [6-ethyl-2-(4-phenylpiperazino)quinolin-1-ium-3-yl]methylammonium Formula: C22H28N4+2 MolecularWeight: 348.48452

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CC(=C([NH+]=C2C=C1)N3CCN(CC3)C4=CC=CC=C4)C[NH3+]

Isomeric SMILES

CCC1=CC2=CC(=C([NH+]=C2C=C1)N3CCN(CC3)C4=CC=CC=C4)C[NH3+]

InChI

InChI=1S/C22H26N4/c1-2-17-8-9-21-18(14-17)15-19(16-23)22(24-21)26-12-10-25(11-13-26)20-6-4-3-5-7-20/h3-9,14-15H,2,10-13,16,23H2,1H3/p+2