2-chloranyl-N-[2-[1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide

Systemtic Name: 2-chloranyl-N-[2-[1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 2-chloro-N-[2-[1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide CAS Name: 2-chloro-N-[2-[1-[(5-methyl-1-propyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 2-chloro-N-[2-[1-[(5-methyl-1-propylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 2-chloro-N-[2-[1-[(5-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Formula: C23H30ClN6O+ MolecularWeight: 441.9769

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C=N1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4Cl)C

Isomeric SMILES

CCCN1C(=C(C=N1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4Cl)C

InChI

InChI=1S/C23H29ClN6O/c1-3-12-29-17(2)18(15-26-29)16-28-13-9-19(10-14-28)30-22(8-11-25-30)27-23(31)20-6-4-5-7-21(20)24/h4-8,11,15,19H,3,9-10,12-14,16H2,1-2H3,(H,27,31)/p+1