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

Systemtic Name: 4-[[(2S)-4-(methoxymethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[(2S)-4-(methoxymethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[(2S)-4-(methoxymethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[(2S)-4-(methoxymethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[(2S)-3-keto-4-(methoxymethyl)-2-methyl-1,4-benzoxazin-6-yl]amino]butyric acid Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)CCC(=O)O)COC

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O6/c1-9-15(21)17(8-22-2)11-7-10(3-4-12(11)23-9)16-13(18)5-6-14(19)20/h3-4,7,9H,5-6,8H2,1-2H3,(H,16,18)(H,19,20)/t9-/m0/s1