N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-4-pyrazol-1-yl-benzamide

Systemtic Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-4-pyrazol-1-yl-benzamide Openeye Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-4-pyrazol-1-yl-benzamide CAS Name: N-ethyl-N-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidin-1-iumyl]methyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-4-pyrazol-1-ylbenzamide Traditional Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-4-pyrazol-1-yl-benzamide Formula: C24H37N5O+2 MolecularWeight: 411.58348

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CC[NH+](CC1)C2CC[NH+](CC2)C)C(=O)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CCN(CC1CC[NH+](CC1)C2CC[NH+](CC2)C)C(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C24H35N5O/c1-3-27(24(30)21-5-7-23(8-6-21)29-14-4-13-25-29)19-20-9-17-28(18-10-20)22-11-15-26(2)16-12-22/h4-8,13-14,20,22H,3,9-12,15-19H2,1-2H3/p+2