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

Systemtic Name: 2-methoxy-N-[2-[1-(naphthalen-1-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 2-methoxy-N-[2-[1-(1-naphthylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide CAS Name: 2-methoxy-N-[2-[1-(1-naphthalenylmethyl)-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 2-methoxy-N-[2-[1-(naphthalen-1-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 2-methoxy-N-[2-[1-(1-naphthylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Formula: C27H29N4O2+ MolecularWeight: 441.54476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H28N4O2/c1-33-25-12-5-4-11-24(25)27(32)29-26-13-16-28-31(26)22-14-17-30(18-15-22)19-21-9-6-8-20-7-2-3-10-23(20)21/h2-13,16,22H,14-15,17-19H2,1H3,(H,29,32)/p+1