4-[(2S)-4-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2S)-4-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(2S)-4-(2-methoxy-2-oxo-ethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]-4-oxo-butanoic acid CAS Name: 4-[(2S)-4-(2-methoxy-2-oxoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoic acid IUPAC Name: 4-[(2S)-4-(2-methoxy-2-oxoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[(2S)-3-keto-4-(2-keto-2-methoxy-ethyl)-2-methyl-1,4-benzoxazin-6-yl]butyric acid Formula: C16H17NO7 MolecularWeight: 335.30868

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCC(=O)O)CC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO7/c1-9-16(22)17(8-15(21)23-2)11-7-10(3-5-13(11)24-9)12(18)4-6-14(19)20/h3,5,7,9H,4,6,8H2,1-2H3,(H,19,20)/t9-/m0/s1