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

Systemtic Name: 4-[2,2-dimethyl-4-[2-(methylamino)-2-oxidanylidene-ethyl]-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[2,2-dimethyl-4-[2-(methylamino)-2-oxo-ethyl]-3-oxo-1,4-benzoxazin-6-yl]-4-oxo-butanoate CAS Name: 4-[2,2-dimethyl-4-[2-(methylamino)-2-oxoethyl]-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoate IUPAC Name: 4-[2,2-dimethyl-4-[2-(methylamino)-2-oxoethyl]-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[3-keto-4-[2-keto-2-(methylamino)ethyl]-2,2-dimethyl-1,4-benzoxazin-6-yl]butyrate Formula: C17H19N2O6- MolecularWeight: 347.34256

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCC(=O)[O-])CC(=O)NC)C

Isomeric SMILES

CC1(C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCC(=O)[O-])CC(=O)NC)C

InChI

InChI=1S/C17H20N2O6/c1-17(2)16(24)19(9-14(21)18-3)11-8-10(4-6-13(11)25-17)12(20)5-7-15(22)23/h4,6,8H,5,7,9H2,1-3H3,(H,18,21)(H,22,23)/p-1