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

Systemtic Name: cyclopentyl 2-[(2R)-3-oxidanylidene-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]ethanoate Openeye Name: cyclopentyl 2-[(2R)-2-isopropyl-3-oxo-6-propanoyl-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2R)-3-oxo-6-(1-oxopropyl)-2-propan-2-yl-1,4-benzoxazin-4-yl]acetic acid cyclopentyl ester IUPAC Name: cyclopentyl 2-[(2R)-3-oxo-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2R)-2-isopropyl-3-keto-6-propionyl-1,4-benzoxazin-4-yl]acetic acid cyclopentyl ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)OC3CCCC3)C(C)C

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC(=O)OC3CCCC3)C(C)C

InChI

InChI=1S/C21H27NO5/c1-4-17(23)14-9-10-18-16(11-14)22(21(25)20(27-18)13(2)3)12-19(24)26-15-7-5-6-8-15/h9-11,13,15,20H,4-8,12H2,1-3H3/t20-/m1/s1