2-[4-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-(1-cyclopropyl-2,5-dimethyl-pyrrole-3-carbonyl)piperazin-1-ium-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-oxomethyl]-1-piperazin-1-iumyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-(1-cyclopropyl-2,5-dimethylpyrrole-3-carbonyl)piperazin-1-ium-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-(1-cyclopropyl-2,5-dimethyl-pyrrole-3-carbonyl)piperazin-1-ium-1-yl]-1-piperidino-ethanone Formula: C21H33N4O2+ MolecularWeight: 373.51232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4

InChI

InChI=1S/C21H32N4O2/c1-16-14-19(17(2)25(16)18-6-7-18)21(27)24-12-10-22(11-13-24)15-20(26)23-8-4-3-5-9-23/h14,18H,3-13,15H2,1-2H3/p+1