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

Systemtic Name: 2-[(2R)-6-methyl-3-oxidanylidene-4-(3-oxidanylpropyl)-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[(2R)-4-(3-hydroxypropyl)-6-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[(2R)-4-(3-hydroxypropyl)-6-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[(2R)-4-(3-hydroxypropyl)-6-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[(2R)-4-(3-hydroxypropyl)-3-keto-6-methyl-1,4-benzoxazin-2-yl]acetic acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(C(=O)N2CCCO)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)O[C@@H](C(=O)N2CCCO)CC(=O)O

InChI

InChI=1S/C14H17NO5/c1-9-3-4-11-10(7-9)15(5-2-6-16)14(19)12(20-11)8-13(17)18/h3-4,7,12,16H,2,5-6,8H2,1H3,(H,17,18)/t12-/m1/s1