[2-[(1,2-dimethyl-3-oxidanylidene-5-pentadecyl-pyrazol-4-yl)amino]-4-methyl-4-oxidanyl-pentan-2-yl]-oxidanyl-oxidanylidene-phosphanium

Systemtic Name: [2-[(1,2-dimethyl-3-oxidanylidene-5-pentadecyl-pyrazol-4-yl)amino]-4-methyl-4-oxidanyl-pentan-2-yl]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [1-[(1,2-dimethyl-3-oxo-5-pentadecyl-pyrazol-4-yl)amino]-3-hydroxy-1,3-dimethyl-butyl]-hydroxy-oxo-phosphonium CAS Name: [2-[(1,2-dimethyl-3-oxo-5-pentadecyl-4-pyrazolyl)amino]-4-hydroxy-4-methylpentan-2-yl]-hydroxy-oxophosphonium IUPAC Name: [2-[(1,2-dimethyl-3-oxo-5-pentadecylpyrazol-4-yl)amino]-4-hydroxy-4-methylpentan-2-yl]-hydroxy-oxophosphanium Traditional Name: hydroxy-[3-hydroxy-1-[(3-keto-1,2-dimethyl-5-pentadecyl-3-pyrazolin-4-yl)amino]-1,3-dimethyl-butyl]-keto-phosphonium Formula: C26H51N3O4P+ MolecularWeight: 500.674601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C(C(=O)N(N1C)C)NC(C)(CC(C)(C)O)[P+](=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C(C(=O)N(N1C)C)NC(C)(CC(C)(C)O)[P+](=O)O

InChI

InChI=1S/C26H50N3O4P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-23(24(30)29(6)28(22)5)27-26(4,34(32)33)21-25(2,3)31/h27,31H,7-21H2,1-6H3/p+1