[1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 3-methyl-1-benzofuran-2-carboxylate Openeye Name: [2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 3-methylbenzofuran-2-carboxylate CAS Name: 3-methyl-2-benzofurancarboxylic acid [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 3-methyl-1-benzofuran-2-carboxylate Traditional Name: 3-methylcoumarilic acid [2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)OC(C)C(=O)NCC3CCCCC3

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)OC(C)C(=O)NCC3CCCCC3

InChI

InChI=1S/C20H25NO4/c1-13-16-10-6-7-11-17(16)25-18(13)20(23)24-14(2)19(22)21-12-15-8-4-3-5-9-15/h6-7,10-11,14-15H,3-5,8-9,12H2,1-2H3,(H,21,22)