1-[2-(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)acetyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)-1-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(7-hydroxy-8-methyl-2-oxochromen-4-yl)acetyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(7-hydroxy-2-keto-8-methyl-chromen-4-yl)acetyl]isonipecotic acid Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CC(=O)N3CCC(CC3)C(=O)O)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CC(=O)N3CCC(CC3)C(=O)O)O

InChI

InChI=1S/C18H19NO6/c1-10-14(20)3-2-13-12(9-16(22)25-17(10)13)8-15(21)19-6-4-11(5-7-19)18(23)24/h2-3,9,11,20H,4-8H2,1H3,(H,23,24)