[2-(3-azanyl-2-methyl-phenyl)-3-oxidanyl-3-oxidanylidene-propyl]-[2-methyl-1-(phenylmethoxycarbonylamino)propoxy]-oxidanylidene-phosphanium

Systemtic Name: [2-(3-azanyl-2-methyl-phenyl)-3-oxidanyl-3-oxidanylidene-propyl]-[2-methyl-1-(phenylmethoxycarbonylamino)propoxy]-oxidanylidene-phosphanium Openeye Name: [2-(3-amino-2-methyl-phenyl)-3-hydroxy-3-oxo-propyl]-[1-(benzyloxycarbonylamino)-2-methyl-propoxy]-oxo-phosphonium CAS Name: [2-(3-amino-2-methylphenyl)-3-hydroxy-3-oxopropyl]-[2-methyl-1-(phenylmethoxycarbonylamino)propoxy]-oxophosphonium IUPAC Name: [2-(3-amino-2-methylphenyl)-3-hydroxy-3-oxopropyl]-[2-methyl-1-(phenylmethoxycarbonylamino)propoxy]-oxophosphanium Traditional Name: [2-(3-amino-2-methyl-phenyl)-3-hydroxy-3-keto-propyl]-[1-(benzyloxycarbonylamino)-2-methyl-propoxy]-keto-phosphonium Formula: C22H28N2O6P+ MolecularWeight: 447.441281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N)C(C[P+](=O)OC(C(C)C)NC(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1N)C(C[P+](=O)OC(C(C)C)NC(=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H27N2O6P/c1-14(2)20(24-22(27)29-12-16-8-5-4-6-9-16)30-31(28)13-18(21(25)26)17-10-7-11-19(23)15(17)3/h4-11,14,18,20H,12-13,23H2,1-3H3,(H-,24,25,26,27)/p+1