4-[2-[4-(4-methoxyphenyl)carbonylpiperidin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[4-(4-methoxyphenyl)carbonylpiperidin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[4-(4-methoxybenzoyl)piperidin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: 4-[[2-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperidin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[4-(4-methoxybenzoyl)piperidin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-(4-p-anisoylpiperidin-1-ium-1-yl)acetyl]amino]benzamide Formula: C22H26N3O4+ MolecularWeight: 396.45954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C22H25N3O4/c1-29-19-8-4-15(5-9-19)21(27)16-10-12-25(13-11-16)14-20(26)24-18-6-2-17(3-7-18)22(23)28/h2-9,16H,10-14H2,1H3,(H2,23,28)(H,24,26)/p+1