4-[(2R)-4-(2-hydroxyethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(2R)-4-(2-hydroxyethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(2R)-4-(2-hydroxyethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]-4-oxo-butanoate CAS Name: 4-[(2R)-4-(2-hydroxyethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoate IUPAC Name: 4-[(2R)-4-(2-hydroxyethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoate Traditional Name: 4-[(2R)-4-(2-hydroxyethyl)-3-keto-2-methyl-1,4-benzoxazin-6-yl]-4-keto-butyrate Formula: C15H16NO6- MolecularWeight: 306.29064

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCC(=O)[O-])CCO

Isomeric SMILES

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCC(=O)[O-])CCO

InChI

InChI=1S/C15H17NO6/c1-9-15(21)16(6-7-17)11-8-10(2-4-13(11)22-9)12(18)3-5-14(19)20/h2,4,8-9,17H,3,5-7H2,1H3,(H,19,20)/p-1/t9-/m1/s1