4-[1-[[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]methyl]indol-3-yl]-1-piperidin-1-yl-butan-1-one

Systemtic Name: 4-[1-[[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]methyl]indol-3-yl]-1-piperidin-1-yl-butan-1-one Openeye Name: 4-[1-[[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]methyl]indol-3-yl]-1-(1-piperidyl)butan-1-one CAS Name: 4-[1-[[4-(4-methyl-2-quinolin-1-iumyl)-1-piperazin-1-iumyl]methyl]-3-indolyl]-1-(1-piperidinyl)-1-butanone IUPAC Name: 4-[1-[[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]methyl]indol-3-yl]-1-piperidin-1-ylbutan-1-one Traditional Name: 4-[1-[[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]methyl]indol-3-yl]-1-piperidino-butan-1-one Formula: C32H41N5O+2 MolecularWeight: 511.70084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=CC=CC=C12)N3CC[NH+](CC3)CN4C=C(C5=CC=CC=C54)CCCC(=O)N6CCCCC6

Isomeric SMILES

CC1=CC(=[NH+]C2=CC=CC=C12)N3CC[NH+](CC3)CN4C=C(C5=CC=CC=C54)CCCC(=O)N6CCCCC6

InChI

InChI=1S/C32H39N5O/c1-25-22-31(33-29-13-5-3-11-27(25)29)35-20-18-34(19-21-35)24-37-23-26(28-12-4-6-14-30(28)37)10-9-15-32(38)36-16-7-2-8-17-36/h3-6,11-14,22-23H,2,7-10,15-21,24H2,1H3/p+2