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

Systemtic Name: 4-[[4-(2-hydroxyethyl)-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[4-(2-hydroxyethyl)-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxo-butanoate CAS Name: 4-[[4-(2-hydroxyethyl)-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoate IUPAC Name: 4-[[4-(2-hydroxyethyl)-2,2-dimethyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoate Traditional Name: 4-[[4-(2-hydroxyethyl)-3-keto-2,2-dimethyl-1,4-benzoxazin-6-yl]amino]-4-keto-butyrate Formula: C16H19N2O6- MolecularWeight: 335.33186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O6/c1-16(2)15(23)18(7-8-19)11-9-10(3-4-12(11)24-16)17-13(20)5-6-14(21)22/h3-4,9,19H,5-8H2,1-2H3,(H,17,20)(H,21,22)/p-1