2-chloranyl-N-[2-[1-(3-cyclopentylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide

Systemtic Name: 2-chloranyl-N-[2-[1-(3-cyclopentylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 2-chloro-N-[2-[1-(3-cyclopentylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide CAS Name: 2-chloro-N-[2-[1-(3-cyclopentylpropyl)-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 2-chloro-N-[2-[1-(3-cyclopentylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 2-chloro-N-[2-[1-(3-cyclopentylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Formula: C23H32ClN4O+ MolecularWeight: 415.97938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCC(C1)CCC[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H31ClN4O/c24-21-10-4-3-9-20(21)23(29)26-22-11-14-25-28(22)19-12-16-27(17-13-19)15-5-8-18-6-1-2-7-18/h3-4,9-11,14,18-19H,1-2,5-8,12-13,15-17H2,(H,26,29)/p+1