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

Systemtic Name: 2-[1-[[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]methyl]indol-3-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[1-[[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]methyl]indol-3-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[1-[[4-(4-methyl-2-quinolin-1-iumyl)-1-piperazin-1-iumyl]methyl]-3-indolyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[1-[[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]methyl]indol-3-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[1-[[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]methyl]indol-3-yl]-1-piperidino-ethanone Formula: C30H37N5O+2 MolecularWeight: 483.64768

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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)CC(=O)N6CCCCC6

Isomeric SMILES

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

InChI

InChI=1S/C30H35N5O/c1-23-19-29(31-27-11-5-3-9-25(23)27)33-17-15-32(16-18-33)22-35-21-24(26-10-4-6-12-28(26)35)20-30(36)34-13-7-2-8-14-34/h3-6,9-12,19,21H,2,7-8,13-18,20,22H2,1H3/p+2