1-[2-(5,7-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(5,7-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(5,7-dimethoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(5,7-dimethoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(2-keto-5,7-dimethoxy-4-methyl-chromen-3-yl)acetyl]isonipecotic acid Formula: C20H23NO7 MolecularWeight: 389.39912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=CC(=C12)OC)OC)CC(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=CC(=C12)OC)OC)CC(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C20H23NO7/c1-11-14(10-17(22)21-6-4-12(5-7-21)19(23)24)20(25)28-16-9-13(26-2)8-15(27-3)18(11)16/h8-9,12H,4-7,10H2,1-3H3,(H,23,24)