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

Systemtic Name: 2-methylpropyl (2R)-2-[(2R)-3-oxidanylidene-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoate Openeye Name: isobutyl (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 2-methylpropyl ester IUPAC Name: 2-methylpropyl (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 isobutyl ester Formula: C21H29NO5 MolecularWeight: 375.45866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO5/c1-7-17(23)15-8-9-18-16(10-15)22(20(24)19(27-18)13(4)5)14(6)21(25)26-11-12(2)3/h8-10,12-14,19H,7,11H2,1-6H3/t14-,19-/m1/s1