1-[4-[[5-[1-methyl-3-(4-methylpiperazin-1-yl)carbonyl-4-naphthalen-1-yl-pyrrol-1-ium-1-yl]imidazol-1-yl]methyl]piperidin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-[[5-[1-methyl-3-(4-methylpiperazin-1-yl)carbonyl-4-naphthalen-1-yl-pyrrol-1-ium-1-yl]imidazol-1-yl]methyl]piperidin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-[[5-[1-methyl-3-(4-methylpiperazine-1-carbonyl)-4-(1-naphthyl)pyrrol-1-ium-1-yl]imidazol-1-yl]methyl]-1-piperidyl]-2-phenoxy-ethanone CAS Name: 1-[4-[[5-[1-methyl-3-[(4-methyl-1-piperazinyl)-oxomethyl]-4-(1-naphthalenyl)-1-pyrrol-1-iumyl]-1-imidazolyl]methyl]-1-piperidinyl]-2-phenoxyethanone IUPAC Name: 1-[4-[[5-[1-methyl-3-(4-methylpiperazine-1-carbonyl)-4-naphthalen-1-ylpyrrol-1-ium-1-yl]imidazol-1-yl]methyl]piperidin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-[[5-[1-methyl-3-(4-methylpiperazine-1-carbonyl)-4-(1-naphthyl)pyrrol-1-ium-1-yl]imidazol-1-yl]methyl]piperidino]-2-phenoxy-ethanone Formula: C38H43N6O3+ MolecularWeight: 631.78642

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=C[N+](C=C2C3=CC=CC4=CC=CC=C43)(C)C5=CN=CN5CC6CCN(CC6)C(=O)COC7=CC=CC=C7

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=C[N+](C=C2C3=CC=CC4=CC=CC=C43)(C)C5=CN=CN5CC6CCN(CC6)C(=O)COC7=CC=CC=C7

InChI

InChI=1S/C38H43N6O3/c1-40-19-21-42(22-20-40)38(46)35-26-44(2,25-34(35)33-14-8-10-30-9-6-7-13-32(30)33)36-23-39-28-43(36)24-29-15-17-41(18-16-29)37(45)27-47-31-11-4-3-5-12-31/h3-14,23,25-26,28-29H,15-22,24,27H2,1-2H3/q+1