3-[4-(15-methylhexadecylamino)phenyl]carbonyloxy-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[4-(15-methylhexadecylamino)phenyl]carbonyloxy-3-oxidanylidene-propanoic acid Openeye Name: 3-[4-(15-methylhexadecylamino)benzoyl]oxy-3-oxo-propanoic acid CAS Name: 3-[[4-(15-methylhexadecylamino)phenyl]-oxomethoxy]-3-oxopropanoic acid IUPAC Name: 3-[4-(15-methylhexadecylamino)benzoyl]oxy-3-oxopropanoic acid Traditional Name: 3-keto-3-[4-(15-methylhexadecylamino)benzoyl]oxy-propionic acid Formula: C27H43NO5 MolecularWeight: 461.63402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(=O)CC(=O)O

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(=O)CC(=O)O

InChI

InChI=1S/C27H43NO5/c1-22(2)15-13-11-9-7-5-3-4-6-8-10-12-14-20-28-24-18-16-23(17-19-24)27(32)33-26(31)21-25(29)30/h16-19,22,28H,3-15,20-21H2,1-2H3,(H,29,30)