2-[2-(4,7-dimethyl-2-oxidanyl-5-oxidanylidene-6,7,8,8a-tetrahydrochromen-3-yl)ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-(4,7-dimethyl-2-oxidanyl-5-oxidanylidene-6,7,8,8a-tetrahydrochromen-3-yl)ethanoylamino]ethanoic acid Openeye Name: 2-[[2-(2-hydroxy-4,7-dimethyl-5-oxo-6,7,8,8a-tetrahydrochromen-3-yl)acetyl]amino]acetic acid CAS Name: 2-[[2-(2-hydroxy-4,7-dimethyl-5-oxo-6,7,8,8a-tetrahydro-1-benzopyran-3-yl)-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-(2-hydroxy-4,7-dimethyl-5-oxo-6,7,8,8a-tetrahydrochromen-3-yl)acetyl]amino]acetic acid Traditional Name: 2-[[2-(2-hydroxy-5-keto-4,7-dimethyl-6,7,8,8a-tetrahydrochromen-3-yl)acetyl]amino]acetic acid Formula: C15H19NO6 MolecularWeight: 309.31446

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2C(=C(C(=C(O2)O)CC(=O)NCC(=O)O)C)C(=O)C1

Isomeric SMILES

CC1CC2C(=C(C(=C(O2)O)CC(=O)NCC(=O)O)C)C(=O)C1

InChI

InChI=1S/C15H19NO6/c1-7-3-10(17)14-8(2)9(15(21)22-11(14)4-7)5-12(18)16-6-13(19)20/h7,11,21H,3-6H2,1-2H3,(H,16,18)(H,19,20)