N-(2-hydroxyphenyl)-1-[2-[(3-methoxyphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-hydroxyphenyl)-1-[2-[(3-methoxyphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(2-hydroxyphenyl)-1-[2-[(3-methoxyphenyl)methyl-methyl-amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: N-(2-hydroxyphenyl)-1-[2-[(3-methoxyphenyl)methyl-methylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-hydroxyphenyl)-1-[2-[(3-methoxyphenyl)methyl-methylamino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(2-hydroxyphenyl)-1-[2-keto-2-[m-anisyl(methyl)amino]ethyl]piperidin-1-ium-4-carboxamide Formula: C23H30N3O4+ MolecularWeight: 412.502

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)OC)C(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O

Isomeric SMILES

CN(CC1=CC(=CC=C1)OC)C(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O

InChI

InChI=1S/C23H29N3O4/c1-25(15-17-6-5-7-19(14-17)30-2)22(28)16-26-12-10-18(11-13-26)23(29)24-20-8-3-4-9-21(20)27/h3-9,14,18,27H,10-13,15-16H2,1-2H3,(H,24,29)/p+1