(2-methoxyphenyl)methyl-methyl-[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl]azanium

Systemtic Name: (2-methoxyphenyl)methyl-methyl-[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl]azanium Openeye Name: (2-methoxyphenyl)methyl-methyl-[2-oxo-2-[3-(1-piperidylsulfonyl)anilino]ethyl]ammonium CAS Name: (2-methoxyphenyl)methyl-methyl-[2-oxo-2-[3-(1-piperidinylsulfonyl)anilino]ethyl]ammonium IUPAC Name: (2-methoxyphenyl)methyl-methyl-[2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl]azanium Traditional Name: [2-keto-2-(3-piperidinosulfonylanilino)ethyl]-methyl-o-anisyl-ammonium Formula: C22H30N3O4S+ MolecularWeight: 432.5563

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1OC)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1OC)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H29N3O4S/c1-24(16-18-9-4-5-12-21(18)29-2)17-22(26)23-19-10-8-11-20(15-19)30(27,28)25-13-6-3-7-14-25/h4-5,8-12,15H,3,6-7,13-14,16-17H2,1-2H3,(H,23,26)/p+1