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

Systemtic Name: 4-[(2R)-2-ethyl-4-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(2R)-2-ethyl-4-(2-methoxy-2-oxo-ethyl)-3-oxo-1,4-benzoxazin-6-yl]-4-oxo-butanoate CAS Name: 4-[(2R)-2-ethyl-4-(2-methoxy-2-oxoethyl)-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoate IUPAC Name: 4-[(2R)-2-ethyl-4-(2-methoxy-2-oxoethyl)-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoate Traditional Name: 4-[(2R)-2-ethyl-3-keto-4-(2-keto-2-methoxy-ethyl)-1,4-benzoxazin-6-yl]-4-keto-butyrate Formula: C17H18NO7- MolecularWeight: 348.32732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCC(=O)[O-])CC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO7/c1-3-13-17(23)18(9-16(22)24-2)11-8-10(4-6-14(11)25-13)12(19)5-7-15(20)21/h4,6,8,13H,3,5,7,9H2,1-2H3,(H,20,21)/p-1/t13-/m1/s1