5-[3-methyl-2-(11-phosphonoundecanoylamino)phenoxy]-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-[3-methyl-2-(11-phosphonoundecanoylamino)phenoxy]-4-oxidanylidene-pentanoic acid Openeye Name: 5-[3-methyl-2-(11-phosphonoundecanoylamino)phenoxy]-4-oxo-pentanoic acid CAS Name: 5-[3-methyl-2-[(1-oxo-11-phosphonoundecyl)amino]phenoxy]-4-oxopentanoic acid IUPAC Name: 5-[3-methyl-2-(11-phosphonoundecanoylamino)phenoxy]-4-oxopentanoic acid Traditional Name: 4-keto-5-[3-methyl-2-(11-phosphonoundecanoylamino)phenoxy]valeric acid Formula: C23H36NO8P MolecularWeight: 485.507601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCC(=O)CCC(=O)O)NC(=O)CCCCCCCCCCP(=O)(O)O

Isomeric SMILES

CC1=C(C(=CC=C1)OCC(=O)CCC(=O)O)NC(=O)CCCCCCCCCCP(=O)(O)O

InChI

InChI=1S/C23H36NO8P/c1-18-11-10-12-20(32-17-19(25)14-15-22(27)28)23(18)24-21(26)13-8-6-4-2-3-5-7-9-16-33(29,30)31/h10-12H,2-9,13-17H2,1H3,(H,24,26)(H,27,28)(H2,29,30,31)