4-[4-(2-methylpropyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[4-(2-methylpropyl)-3-oxidanylidene-1,4-benzoxazin-6-yl]-4-oxidanylidene-butanoate Openeye Name: 4-(4-isobutyl-3-oxo-1,4-benzoxazin-6-yl)-4-oxo-butanoate CAS Name: 4-[4-(2-methylpropyl)-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoate IUPAC Name: 4-[4-(2-methylpropyl)-3-oxo-1,4-benzoxazin-6-yl]-4-oxobutanoate Traditional Name: 4-(4-isobutyl-3-keto-1,4-benzoxazin-6-yl)-4-keto-butyrate Formula: C16H18NO5- MolecularWeight: 304.31782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)COC2=C1C=C(C=C2)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC(C)CN1C(=O)COC2=C1C=C(C=C2)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C16H19NO5/c1-10(2)8-17-12-7-11(13(18)4-6-16(20)21)3-5-14(12)22-9-15(17)19/h3,5,7,10H,4,6,8-9H2,1-2H3,(H,20,21)/p-1