2-[[(dodecylamino)-phenyl-methyl]-oxidanyl-phosphoryl]oxy-2-methyl-propanoic acid

Systemtic Name: 2-[[(dodecylamino)-phenyl-methyl]-oxidanyl-phosphoryl]oxy-2-methyl-propanoic acid Openeye Name: 2-[[(dodecylamino)-phenyl-methyl]-hydroxy-phosphoryl]oxy-2-methyl-propanoic acid CAS Name: 2-[[(dodecylamino)-phenylmethyl]-hydroxyphosphoryl]oxy-2-methylpropanoic acid IUPAC Name: 2-[[(dodecylamino)-phenylmethyl]-hydroxyphosphoryl]oxy-2-methylpropanoic acid Traditional Name: 2-[hydroxy-[(laurylamino)-phenyl-methyl]phosphoryl]oxy-2-methyl-propionic acid Formula: C23H40NO5P MolecularWeight: 441.541161

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(C1=CC=CC=C1)P(=O)(O)OC(C)(C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCNC(C1=CC=CC=C1)P(=O)(O)OC(C)(C)C(=O)O

InChI

InChI=1S/C23H40NO5P/c1-4-5-6-7-8-9-10-11-12-16-19-24-21(20-17-14-13-15-18-20)30(27,28)29-23(2,3)22(25)26/h13-15,17-18,21,24H,4-12,16,19H2,1-3H3,(H,25,26)(H,27,28)