2-[(2R)-4-(carboxymethyl)-6-methyl-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoic acid

Systemtic Name: 2-[(2R)-4-(carboxymethyl)-6-methyl-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[(2R)-4-(carboxymethyl)-6-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[(2R)-4-(carboxymethyl)-6-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[(2R)-4-(carboxymethyl)-6-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[(2R)-4-(carboxymethyl)-3-keto-6-methyl-1,4-benzoxazin-2-yl]acetic acid Formula: C13H13NO6 MolecularWeight: 279.24542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(C(=O)N2CC(=O)O)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)O[C@@H](C(=O)N2CC(=O)O)CC(=O)O

InChI

InChI=1S/C13H13NO6/c1-7-2-3-9-8(4-7)14(6-12(17)18)13(19)10(20-9)5-11(15)16/h2-4,10H,5-6H2,1H3,(H,15,16)(H,17,18)/t10-/m1/s1