(1-azanyl-3-oxidanyl-1-oxidanylidene-propan-2-yl)-[(4-methoxyphenyl)methyl]-oxidanyl-(phenylsulfonyl)azanium

Systemtic Name: (1-azanyl-3-oxidanyl-1-oxidanylidene-propan-2-yl)-[(4-methoxyphenyl)methyl]-oxidanyl-(phenylsulfonyl)azanium Openeye Name: [2-amino-1-(hydroxymethyl)-2-oxo-ethyl]-(benzenesulfonyl)-hydroxy-[(4-methoxyphenyl)methyl]ammonium CAS Name: (1-amino-3-hydroxy-1-oxopropan-2-yl)-(benzenesulfonyl)-hydroxy-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: (1-amino-3-hydroxy-1-oxopropan-2-yl)-(benzenesulfonyl)-hydroxy-[(4-methoxyphenyl)methyl]azanium Traditional Name: (2-amino-2-keto-1-methylol-ethyl)-besyl-hydroxy-p-anisyl-ammonium Formula: C17H21N2O6S+ MolecularWeight: 381.42344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[N+](C(CO)C(=O)N)(O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)C[N+](C(CO)C(=O)N)(O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H20N2O6S/c1-25-14-9-7-13(8-10-14)11-19(22,16(12-20)17(18)21)26(23,24)15-5-3-2-4-6-15/h2-10,16,20,22H,11-12H2,1H3,(H-,18,21)/p+1