methyl 5-cyano-5-(7-methoxy-2-propan-2-yl-1,3-benzoxazol-4-yl)-2-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl 5-cyano-5-(7-methoxy-2-propan-2-yl-1,3-benzoxazol-4-yl)-2-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: methyl 5-cyano-5-(2-isopropyl-7-methoxy-1,3-benzoxazol-4-yl)-2-oxo-cyclohexanecarboxylate CAS Name: 5-cyano-5-(7-methoxy-2-propan-2-yl-1,3-benzoxazol-4-yl)-2-oxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-5-(7-methoxy-2-propan-2-yl-1,3-benzoxazol-4-yl)-2-oxocyclohexane-1-carboxylate Traditional Name: 5-cyano-5-(2-isopropyl-7-methoxy-1,3-benzoxazol-4-yl)-2-keto-cyclohexanecarboxylic acid methyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=CC(=C2O1)OC)C3(CCC(=O)C(C3)C(=O)OC)C#N

Isomeric SMILES

CC(C)C1=NC2=C(C=CC(=C2O1)OC)C3(CCC(=O)C(C3)C(=O)OC)C#N

InChI

InChI=1S/C20H22N2O5/c1-11(2)18-22-16-13(5-6-15(25-3)17(16)27-18)20(10-21)8-7-14(23)12(9-20)19(24)26-4/h5-6,11-12H,7-9H2,1-4H3