methyl (2R)-2-[(2R)-3-oxidanylidene-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate

Systemtic Name: methyl (2R)-2-[(2R)-3-oxidanylidene-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate Openeye Name: methyl (2R)-2-[(2R)-2-isopropyl-3-oxo-6-propanoyl-1,4-benzoxazin-4-yl]propanoate CAS Name: (2R)-2-[(2R)-3-oxo-6-(1-oxopropyl)-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(2R)-3-oxo-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2R)-2-[(2R)-2-isopropyl-3-keto-6-propionyl-1,4-benzoxazin-4-yl]propionic acid methyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2C(C)C(=O)OC)C(C)C

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2[C@H](C)C(=O)OC)C(C)C

InChI

InChI=1S/C18H23NO5/c1-6-14(20)12-7-8-15-13(9-12)19(11(4)18(22)23-5)17(21)16(24-15)10(2)3/h7-11,16H,6H2,1-5H3/t11-,16-/m1/s1