N-cyclopropyl-4-methoxy-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-cyclopropyl-4-methoxy-3-[1-(phenylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: 3-(1-benzylpiperidin-1-ium-4-yl)oxy-N-cyclopropyl-4-methoxy-benzamide CAS Name: N-cyclopropyl-4-methoxy-3-[[1-(phenylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: 3-(1-benzylpiperidin-1-ium-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide Traditional Name: 3-(1-benzylpiperidin-1-ium-4-yl)oxy-N-cyclopropyl-4-methoxy-benzamide Formula: C23H29N2O3+ MolecularWeight: 381.48796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2CC2)OC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2CC2)OC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N2O3/c1-27-21-10-7-18(23(26)24-19-8-9-19)15-22(21)28-20-11-13-25(14-12-20)16-17-5-3-2-4-6-17/h2-7,10,15,19-20H,8-9,11-14,16H2,1H3,(H,24,26)/p+1