[5-methyl-2-(octanoylamino)phenyl]methylphosphonic acid

Systemtic Name: [5-methyl-2-(octanoylamino)phenyl]methylphosphonic acid Openeye Name: [5-methyl-2-(octanoylamino)phenyl]methylphosphonic acid CAS Name: [5-methyl-2-(1-oxooctylamino)phenyl]methylphosphonic acid IUPAC Name: [5-methyl-2-(octanoylamino)phenyl]methylphosphonic acid Traditional Name: [2-(caprylylamino)-5-methyl-benzyl]phosphonic acid Formula: C16H26NO4P MolecularWeight: 327.355701

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=C(C=C(C=C1)C)CP(=O)(O)O

Isomeric SMILES

CCCCCCCC(=O)NC1=C(C=C(C=C1)C)CP(=O)(O)O

InChI

InChI=1S/C16H26NO4P/c1-3-4-5-6-7-8-16(18)17-15-10-9-13(2)11-14(15)12-22(19,20)21/h9-11H,3-8,12H2,1-2H3,(H,17,18)(H2,19,20,21)