methyl 2-[(2R)-6-butanoyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate

Systemtic Name: methyl 2-[(2R)-6-butanoyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate Openeye Name: methyl 2-[(2R)-6-butanoyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2R)-2-methyl-3-oxo-6-(1-oxobutyl)-1,4-benzoxazin-4-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R)-6-butanoyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2R)-6-butyryl-3-keto-2-methyl-1,4-benzoxazin-4-yl]acetic acid methyl ester Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)OC)C

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC(=O)OC)C

InChI

InChI=1S/C16H19NO5/c1-4-5-13(18)11-6-7-14-12(8-11)17(9-15(19)21-3)16(20)10(2)22-14/h6-8,10H,4-5,9H2,1-3H3/t10-/m1/s1