2-methoxy-N-[2-[1-(quinolin-8-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide

Systemtic Name: 2-methoxy-N-[2-[1-(quinolin-8-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 2-methoxy-N-[2-[1-(8-quinolylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide CAS Name: 2-methoxy-N-[2-[1-(8-quinolinylmethyl)-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 2-methoxy-N-[2-[1-(quinolin-8-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 2-methoxy-N-[2-[1-(8-quinolylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Formula: C26H28N5O2+ MolecularWeight: 442.53282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C26H27N5O2/c1-33-23-10-3-2-9-22(23)26(32)29-24-11-15-28-31(24)21-12-16-30(17-13-21)18-20-7-4-6-19-8-5-14-27-25(19)20/h2-11,14-15,21H,12-13,16-18H2,1H3,(H,29,32)/p+1