3,5-diethyl-4-[(2,5,6-trimethyl-4-oxidanylidene-pyran-3-yl)carbonylamino]benzoic acid

Systemtic Name: 3,5-diethyl-4-[(2,5,6-trimethyl-4-oxidanylidene-pyran-3-yl)carbonylamino]benzoic acid Openeye Name: 3,5-diethyl-4-[(2,5,6-trimethyl-4-oxo-pyran-3-carbonyl)amino]benzoic acid CAS Name: 3,5-diethyl-4-[[oxo-(2,5,6-trimethyl-4-oxo-3-pyranyl)methyl]amino]benzoic acid IUPAC Name: 3,5-diethyl-4-[(2,5,6-trimethyl-4-oxopyran-3-carbonyl)amino]benzoic acid Traditional Name: 3,5-diethyl-4-[(4-keto-2,5,6-trimethyl-pyran-3-carbonyl)amino]benzoic acid Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1NC(=O)C2=C(OC(=C(C2=O)C)C)C)CC)C(=O)O

Isomeric SMILES

CCC1=CC(=CC(=C1NC(=O)C2=C(OC(=C(C2=O)C)C)C)CC)C(=O)O

InChI

InChI=1S/C20H23NO5/c1-6-13-8-15(20(24)25)9-14(7-2)17(13)21-19(23)16-12(5)26-11(4)10(3)18(16)22/h8-9H,6-7H2,1-5H3,(H,21,23)(H,24,25)