4-[4-(decylamino)phenyl]carbonyloxy-3-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(decylamino)phenyl]carbonyloxy-3-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(decylamino)benzoyl]oxy-3-hydroxy-4-oxo-butanoic acid CAS Name: 4-[[4-(decylamino)phenyl]-oxomethoxy]-3-hydroxy-4-oxobutanoic acid IUPAC Name: 4-[4-(decylamino)benzoyl]oxy-3-hydroxy-4-oxobutanoic acid Traditional Name: 4-[4-(decylamino)benzoyl]oxy-3-hydroxy-4-keto-butyric acid Formula: C21H31NO6 MolecularWeight: 393.47394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(=O)C(CC(=O)O)O

Isomeric SMILES

CCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(=O)C(CC(=O)O)O

InChI

InChI=1S/C21H31NO6/c1-2-3-4-5-6-7-8-9-14-22-17-12-10-16(11-13-17)20(26)28-21(27)18(23)15-19(24)25/h10-13,18,22-23H,2-9,14-15H2,1H3,(H,24,25)