(2,3-dimethoxyphenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl]azanium

Systemtic Name: (2,3-dimethoxyphenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl]azanium Openeye Name: (2,3-dimethoxyphenyl)methyl-methyl-[(1R)-1-methyl-2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]ammonium CAS Name: (2,3-dimethoxyphenyl)methyl-methyl-[(2R)-1-oxo-1-[4-(1-pyrrolidinylsulfonyl)anilino]propan-2-yl]ammonium IUPAC Name: (2,3-dimethoxyphenyl)methyl-methyl-[(2R)-1-oxo-1-(4-pyrrolidin-1-ylsulfonylanilino)propan-2-yl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(4-pyrrolidinosulfonylanilino)ethyl]-methyl-o-veratryl-ammonium Formula: C23H32N3O5S+ MolecularWeight: 462.58228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)[NH+](C)CC3=C(C(=CC=C3)OC)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)[NH+](C)CC3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C23H31N3O5S/c1-17(25(2)16-18-8-7-9-21(30-3)22(18)31-4)23(27)24-19-10-12-20(13-11-19)32(28,29)26-14-5-6-15-26/h7-13,17H,5-6,14-16H2,1-4H3,(H,24,27)/p+1/t17-/m1/s1