[2-methyl-1-(phenylmethoxycarbonylamino)-2-sulfanyl-propyl]-oxidanyl-oxidanylidene-phosphanium

Systemtic Name: [2-methyl-1-(phenylmethoxycarbonylamino)-2-sulfanyl-propyl]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [1-(benzyloxycarbonylamino)-2-methyl-2-sulfanyl-propyl]-hydroxy-oxo-phosphonium CAS Name: hydroxy-[2-mercapto-2-methyl-1-(phenylmethoxycarbonylamino)propyl]-oxophosphonium IUPAC Name: hydroxy-[2-methyl-1-(phenylmethoxycarbonylamino)-2-sulfanylpropyl]-oxophosphanium Traditional Name: [1-(benzyloxycarbonylamino)-2-mercapto-2-methyl-propyl]-hydroxy-keto-phosphonium Formula: C12H17NO4PS+ MolecularWeight: 302.306441

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(NC(=O)OCC1=CC=CC=C1)[P+](=O)O)S

Isomeric SMILES

CC(C)(C(NC(=O)OCC1=CC=CC=C1)[P+](=O)O)S

InChI

InChI=1S/C12H16NO4PS/c1-12(2,19)10(18(15)16)13-11(14)17-8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3,(H2-,13,14,15,16,19)/p+1