2-[4-[(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-[(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-[(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[(1-cyclohexyl-2,5-dimethyl-3-pyrrolyl)methyl]-1-piperazine-1,4-diiumyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-[(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-[(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-acetamide Formula: C22H38N4O+2 MolecularWeight: 374.56332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CCCCC2)C)C[NH+]3CC[NH+](CC3)CC(=O)NC4CC4

Isomeric SMILES

CC1=CC(=C(N1C2CCCCC2)C)C[NH+]3CC[NH+](CC3)CC(=O)NC4CC4

InChI

InChI=1S/C22H36N4O/c1-17-14-19(18(2)26(17)21-6-4-3-5-7-21)15-24-10-12-25(13-11-24)16-22(27)23-20-8-9-20/h14,20-21H,3-13,15-16H2,1-2H3,(H,23,27)/p+2