1-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: 1-[2-[4-methyl-5,7-bis(oxidanyl)-2-oxidanylidene-chromen-3-yl]ethanoyl]piperidine-4-carboxylate Openeye Name: 1-[2-(5,7-dihydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(5,7-dihydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]-4-piperidinecarboxylate IUPAC Name: 1-[2-(5,7-dihydroxy-4-methyl-2-oxochromen-3-yl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(5,7-dihydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]isonipecotate Formula: C18H18NO7- MolecularWeight: 360.33802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=CC(=C12)O)O)CC(=O)N3CCC(CC3)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=CC(=C12)O)O)CC(=O)N3CCC(CC3)C(=O)[O-]

InChI

InChI=1S/C18H19NO7/c1-9-12(8-15(22)19-4-2-10(3-5-19)17(23)24)18(25)26-14-7-11(20)6-13(21)16(9)14/h6-7,10,20-21H,2-5,8H2,1H3,(H,23,24)/p-1