1-ethyl-4-(2-methoxyphenyl)-1-methyl-3-(1-methylpyrrol-2-yl)-5-piperazin-1-yl-piperidin-1-ium-2-one

Systemtic Name: 1-ethyl-4-(2-methoxyphenyl)-1-methyl-3-(1-methylpyrrol-2-yl)-5-piperazin-1-yl-piperidin-1-ium-2-one Openeye Name: 1-ethyl-4-(2-methoxyphenyl)-1-methyl-3-(1-methylpyrrol-2-yl)-5-piperazin-1-yl-piperidin-1-ium-2-one CAS Name: 1-ethyl-4-(2-methoxyphenyl)-1-methyl-3-(1-methyl-2-pyrrolyl)-5-(1-piperazinyl)-2-piperidin-1-iumone IUPAC Name: 1-ethyl-4-(2-methoxyphenyl)-1-methyl-3-(1-methylpyrrol-2-yl)-5-piperazin-1-ylpiperidin-1-ium-2-one Traditional Name: 1-ethyl-4-(2-methoxyphenyl)-1-methyl-3-(1-methylpyrrol-2-yl)-5-piperazino-piperidin-1-ium-2-one Formula: C24H35N4O2+ MolecularWeight: 411.5603

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CC(C(C(C1=O)C2=CC=CN2C)C3=CC=CC=C3OC)N4CCNCC4)C

Isomeric SMILES

CC[N+]1(CC(C(C(C1=O)C2=CC=CN2C)C3=CC=CC=C3OC)N4CCNCC4)C

InChI

InChI=1S/C24H35N4O2/c1-5-28(3)17-20(27-15-12-25-13-16-27)22(18-9-6-7-11-21(18)30-4)23(24(28)29)19-10-8-14-26(19)2/h6-11,14,20,22-23,25H,5,12-13,15-17H2,1-4H3/q+1