(3-methoxyphenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl]azanium

Systemtic Name: (3-methoxyphenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl]azanium Openeye Name: (3-methoxyphenyl)methyl-methyl-[(1R)-1-methyl-2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl]ammonium CAS Name: (3-methoxyphenyl)methyl-methyl-[(2R)-1-oxo-1-[4-(1-piperidinylsulfonyl)anilino]propan-2-yl]ammonium IUPAC Name: (3-methoxyphenyl)methyl-methyl-[(2R)-1-oxo-1-(4-piperidin-1-ylsulfonylanilino)propan-2-yl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(4-piperidinosulfonylanilino)ethyl]-m-anisyl-methyl-ammonium Formula: C23H32N3O4S+ MolecularWeight: 446.58288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)[NH+](C)CC3=CC(=CC=C3)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)[NH+](C)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C23H31N3O4S/c1-18(25(2)17-19-8-7-9-21(16-19)30-3)23(27)24-20-10-12-22(13-11-20)31(28,29)26-14-5-4-6-15-26/h7-13,16,18H,4-6,14-15,17H2,1-3H3,(H,24,27)/p+1/t18-/m1/s1