2-(3,4-dihydro-2H-quinolin-1-yl)ethyl-[1-[4-(4-ethylpiperazin-4-ium-1-yl)carbonylphenyl]piperidin-4-yl]azanium

Systemtic Name: 2-(3,4-dihydro-2H-quinolin-1-yl)ethyl-[1-[4-(4-ethylpiperazin-4-ium-1-yl)carbonylphenyl]piperidin-4-yl]azanium Openeye Name: 2-(3,4-dihydro-2H-quinolin-1-yl)ethyl-[1-[4-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]-4-piperidyl]ammonium CAS Name: 2-(3,4-dihydro-2H-quinolin-1-yl)ethyl-[1-[4-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]-4-piperidinyl]ammonium IUPAC Name: 2-(3,4-dihydro-2H-quinolin-1-yl)ethyl-[1-[4-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]piperidin-4-yl]azanium Traditional Name: 2-(3,4-dihydro-2H-quinolin-1-yl)ethyl-[1-[4-(4-ethylpiperazin-4-ium-1-carbonyl)phenyl]-4-piperidyl]ammonium Formula: C29H43N5O+2 MolecularWeight: 477.68462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)N3CCC(CC3)[NH2+]CCN4CCCC5=CC=CC=C54

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)N3CCC(CC3)[NH2+]CCN4CCCC5=CC=CC=C54

InChI

InChI=1S/C29H41N5O/c1-2-31-20-22-34(23-21-31)29(35)25-9-11-27(12-10-25)32-17-13-26(14-18-32)30-15-19-33-16-5-7-24-6-3-4-8-28(24)33/h3-4,6,8-12,26,30H,2,5,7,13-23H2,1H3/p+2