1-(6-piperazin-4-ium-1-yl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one

Systemtic Name: 1-(6-piperazin-4-ium-1-yl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one Openeye Name: 1-(6-piperazin-4-ium-1-yl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one CAS Name: 1-[6-(1-piperazin-4-iumyl)-3,4-dihydro-2H-quinolin-1-yl]-1-butanone IUPAC Name: 1-(6-piperazin-4-ium-1-yl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one Traditional Name: 1-(6-piperazin-4-ium-1-yl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCCC2=C1C=CC(=C2)N3CC[NH2+]CC3

Isomeric SMILES

CCCC(=O)N1CCCC2=C1C=CC(=C2)N3CC[NH2+]CC3

InChI

InChI=1S/C17H25N3O/c1-2-4-17(21)20-10-3-5-14-13-15(6-7-16(14)20)19-11-8-18-9-12-19/h6-7,13,18H,2-5,8-12H2,1H3/p+1