2-[(2R)-6-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethyl cyclohexanecarboxylate

Systemtic Name: 2-[(2R)-6-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethyl cyclohexanecarboxylate Openeye Name: 2-[(2R)-6-(2-methoxy-2-oxo-ethyl)-3-oxo-4H-1,4-benzoxazin-2-yl]ethyl cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid 2-[(2R)-6-(2-methoxy-2-oxoethyl)-3-oxo-4H-1,4-benzoxazin-2-yl]ethyl ester IUPAC Name: 2-[(2R)-6-(2-methoxy-2-oxoethyl)-3-oxo-4H-1,4-benzoxazin-2-yl]ethyl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid 2-[(2R)-3-keto-6-(2-keto-2-methoxy-ethyl)-4H-1,4-benzoxazin-2-yl]ethyl ester Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC2=C(C=C1)OC(C(=O)N2)CCOC(=O)C3CCCCC3

Isomeric SMILES

COC(=O)CC1=CC2=C(C=C1)O[C@@H](C(=O)N2)CCOC(=O)C3CCCCC3

InChI

InChI=1S/C20H25NO6/c1-25-18(22)12-13-7-8-16-15(11-13)21-19(23)17(27-16)9-10-26-20(24)14-5-3-2-4-6-14/h7-8,11,14,17H,2-6,9-10,12H2,1H3,(H,21,23)/t17-/m1/s1