7-[4-[4-(2-bromophenyl)piperazin-1-ium-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one

Systemtic Name: 7-[4-[4-(2-bromophenyl)piperazin-1-ium-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one Openeye Name: 7-[4-[4-(2-bromophenyl)piperazin-1-ium-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one CAS Name: 7-[4-[4-(2-bromophenyl)-1-piperazin-1-iumyl]butoxy]-3,4-dihydro-1H-quinolin-2-one IUPAC Name: 7-[4-[4-(2-bromophenyl)piperazin-1-ium-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one Traditional Name: 7-[4-[4-(2-bromophenyl)piperazin-1-ium-1-yl]butoxy]-3,4-dihydrocarbostyril Formula: C23H29BrN3O2+ MolecularWeight: 459.39926

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=CC(=C2)OCCCC[NH+]3CCN(CC3)C4=CC=CC=C4Br

Isomeric SMILES

C1CC(=O)NC2=C1C=CC(=C2)OCCCC[NH+]3CCN(CC3)C4=CC=CC=C4Br

InChI

InChI=1S/C23H28BrN3O2/c24-20-5-1-2-6-22(20)27-14-12-26(13-15-27)11-3-4-16-29-19-9-7-18-8-10-23(28)25-21(18)17-19/h1-2,5-7,9,17H,3-4,8,10-16H2,(H,25,28)/p+1