trimethyl-[(2R)-4-oxidanyl-4-oxidanylidene-2-[(3-phenylmethoxyphenyl)sulfonylamino]butyl]azanium

Systemtic Name: trimethyl-[(2R)-4-oxidanyl-4-oxidanylidene-2-[(3-phenylmethoxyphenyl)sulfonylamino]butyl]azanium Openeye Name: [(2R)-2-[(3-benzyloxyphenyl)sulfonylamino]-4-hydroxy-4-oxo-butyl]-trimethyl-ammonium CAS Name: [(2R)-4-hydroxy-4-oxo-2-[(3-phenylmethoxyphenyl)sulfonylamino]butyl]-trimethylammonium IUPAC Name: [(2R)-4-hydroxy-4-oxo-2-[(3-phenylmethoxyphenyl)sulfonylamino]butyl]-trimethylazanium Traditional Name: [(2R)-2-[(3-benzoxyphenyl)sulfonylamino]-4-hydroxy-4-keto-butyl]-trimethyl-ammonium Formula: C20H27N2O5S+ MolecularWeight: 407.50378

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)O)NS(=O)(=O)C1=CC=CC(=C1)OCC2=CC=CC=C2

Isomeric SMILES

C[N+](C)(C)C[C@@H](CC(=O)O)NS(=O)(=O)C1=CC=CC(=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O5S/c1-22(2,3)14-17(12-20(23)24)21-28(25,26)19-11-7-10-18(13-19)27-15-16-8-5-4-6-9-16/h4-11,13,17,21H,12,14-15H2,1-3H3/p+1/t17-/m1/s1