2-[[1-[2-(4,7-dimethyl-5-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoyl]piperidin-4-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[1-[2-(4,7-dimethyl-5-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoyl]piperidin-4-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[1-[2-(5-hydroxy-4,7-dimethyl-2-oxo-chromen-3-yl)acetyl]piperidine-4-carbonyl]amino]acetic acid CAS Name: 2-[[[1-[2-(5-hydroxy-4,7-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]-4-piperidinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[1-[2-(5-hydroxy-4,7-dimethyl-2-oxochromen-3-yl)acetyl]piperidine-4-carbonyl]amino]acetic acid Traditional Name: 2-[[1-[2-(5-hydroxy-2-keto-4,7-dimethyl-chromen-3-yl)acetyl]isonipecotoyl]amino]acetic acid Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CCC(CC3)C(=O)NCC(=O)O)C)C(=C1)O

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CCC(CC3)C(=O)NCC(=O)O)C)C(=C1)O

InChI

InChI=1S/C21H24N2O7/c1-11-7-15(24)19-12(2)14(21(29)30-16(19)8-11)9-17(25)23-5-3-13(4-6-23)20(28)22-10-18(26)27/h7-8,13,24H,3-6,9-10H2,1-2H3,(H,22,28)(H,26,27)