3-(1H-indol-3-yl)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1H-indol-3-yl)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]propan-1-one Openeye Name: 3-(1H-indol-3-yl)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]propan-1-one CAS Name: 3-(1H-indol-3-yl)-1-[4-(4-methyl-2-quinolin-1-iumyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1H-indol-3-yl)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazin-1-yl]propan-1-one Traditional Name: 3-(1H-indol-3-yl)-1-[4-(4-methylquinolin-1-ium-2-yl)piperazino]propan-1-one Formula: C25H27N4O+ MolecularWeight: 399.50808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=CC=CC=C12)N3CCN(CC3)C(=O)CCC4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=[NH+]C2=CC=CC=C12)N3CCN(CC3)C(=O)CCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C25H26N4O/c1-18-16-24(27-23-9-5-2-6-20(18)23)28-12-14-29(15-13-28)25(30)11-10-19-17-26-22-8-4-3-7-21(19)22/h2-9,16-17,26H,10-15H2,1H3/p+1