N,2,5-trimethyl-N-[(1R)-2-phenyl-1-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]ethyl]pyrazole-3-carboxamide

Systemtic Name: N,2,5-trimethyl-N-[(1R)-2-phenyl-1-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]ethyl]pyrazole-3-carboxamide Openeye Name: N,2,5-trimethyl-N-[(1R)-2-phenyl-1-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]ethyl]pyrazole-3-carboxamide CAS Name: N,2,5-trimethyl-N-[(1R)-2-phenyl-1-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]ethyl]-3-pyrazolecarboxamide IUPAC Name: N,2,5-trimethyl-N-[(1R)-2-phenyl-1-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]ethyl]pyrazole-3-carboxamide Traditional Name: N,2,5-trimethyl-N-[(1R)-2-phenyl-1-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]ethyl]pyrazole-3-carboxamide Formula: C26H34N5O+ MolecularWeight: 432.58106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)N(C)C(CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=CN=CC=C4)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)N(C)[C@H](CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=CN=CC=C4)C

InChI

InChI=1S/C26H33N5O/c1-20-16-25(30(3)28-20)26(32)29(2)24(17-21-8-5-4-6-9-21)23-11-14-31(15-12-23)19-22-10-7-13-27-18-22/h4-10,13,16,18,23-24H,11-12,14-15,17,19H2,1-3H3/p+1/t24-/m1/s1