(4-ethoxy-3-methoxy-phenyl)methyl-ethyl-[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl]azanium

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl-ethyl-[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl]azanium Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl-ethyl-[2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl]ammonium CAS Name: (4-ethoxy-3-methoxyphenyl)methyl-ethyl-[2-oxo-2-[4-(1-piperidinylsulfonyl)anilino]ethyl]ammonium IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl-ethyl-[2-oxo-2-(4-piperidin-1-ylsulfonylanilino)ethyl]azanium Traditional Name: (4-ethoxy-3-methoxy-benzyl)-ethyl-[2-keto-2-(4-piperidinosulfonylanilino)ethyl]ammonium Formula: C25H36N3O5S+ MolecularWeight: 490.63544

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OCC)OC)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OCC)OC)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C25H35N3O5S/c1-4-27(18-20-9-14-23(33-5-2)24(17-20)32-3)19-25(29)26-21-10-12-22(13-11-21)34(30,31)28-15-7-6-8-16-28/h9-14,17H,4-8,15-16,18-19H2,1-3H3,(H,26,29)/p+1