N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-propan-2-yloxy-benzamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-propan-2-yloxy-benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-isopropoxy-benzamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-propan-2-yloxybenzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-propan-2-yloxybenzamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-isopropoxy-benzamide Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2/c1-17(2)26-21-10-6-9-19(15-21)22(25)23-20-11-13-24(14-12-20)16-18-7-4-3-5-8-18/h3-10,15,17,20H,11-14,16H2,1-2H3,(H,23,25)/p+1