4-[[(2R)-2-ethyl-4-(methoxymethyl)-3-oxidanylidene-1,4-benzoxazin-7-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[(2R)-2-ethyl-4-(methoxymethyl)-3-oxidanylidene-1,4-benzoxazin-7-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[(2R)-2-ethyl-4-(methoxymethyl)-3-oxo-1,4-benzoxazin-7-yl]amino]-4-oxo-butanoate CAS Name: 4-[[(2R)-2-ethyl-4-(methoxymethyl)-3-oxo-1,4-benzoxazin-7-yl]amino]-4-oxobutanoate IUPAC Name: 4-[[(2R)-2-ethyl-4-(methoxymethyl)-3-oxo-1,4-benzoxazin-7-yl]amino]-4-oxobutanoate Traditional Name: 4-[[(2R)-2-ethyl-3-keto-4-(methoxymethyl)-1,4-benzoxazin-7-yl]amino]-4-keto-butyrate Formula: C16H19N2O6- MolecularWeight: 335.33186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=C(C=C2)NC(=O)CCC(=O)[O-])COC

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O6/c1-3-12-16(22)18(9-23-2)11-5-4-10(8-13(11)24-12)17-14(19)6-7-15(20)21/h4-5,8,12H,3,6-7,9H2,1-2H3,(H,17,19)(H,20,21)/p-1/t12-/m1/s1