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

Systemtic Name: N-(2-hydroxyphenyl)-1-[2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(2-hydroxyphenyl)-1-[2-oxo-2-(2-phenylsulfanylanilino)ethyl]piperidin-1-ium-4-carboxamide CAS Name: N-(2-hydroxyphenyl)-1-[2-oxo-2-[2-(phenylthio)anilino]ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-hydroxyphenyl)-1-[2-oxo-2-(2-phenylsulfanylanilino)ethyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(2-hydroxyphenyl)-1-[2-keto-2-[2-(phenylthio)anilino]ethyl]piperidin-1-ium-4-carboxamide Formula: C26H28N3O3S+ MolecularWeight: 462.58382

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2O)CC(=O)NC3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2O)CC(=O)NC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O3S/c30-23-12-6-4-10-21(23)28-26(32)19-14-16-29(17-15-19)18-25(31)27-22-11-5-7-13-24(22)33-20-8-2-1-3-9-20/h1-13,19,30H,14-18H2,(H,27,31)(H,28,32)/p+1