[2-(5-methylhexan-2-ylamino)-2-oxidanylidene-ethyl] 3-(methoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [2-(5-methylhexan-2-ylamino)-2-oxidanylidene-ethyl] 3-(methoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: [2-(1,4-dimethylpentylamino)-2-oxo-ethyl] 3-(methoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(methoxymethyl)-2-benzofurancarboxylic acid [2-(5-methylhexan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(5-methylhexan-2-ylamino)-2-oxoethyl] 3-(methoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(methoxymethyl)coumarilic acid [2-(1,4-dimethylpentylamino)-2-keto-ethyl] ester Formula: C20H27NO5 MolecularWeight: 361.43208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)COC(=O)C1=C(C2=CC=CC=C2O1)COC

Isomeric SMILES

CC(C)CCC(C)NC(=O)COC(=O)C1=C(C2=CC=CC=C2O1)COC

InChI

InChI=1S/C20H27NO5/c1-13(2)9-10-14(3)21-18(22)12-25-20(23)19-16(11-24-4)15-7-5-6-8-17(15)26-19/h5-8,13-14H,9-12H2,1-4H3,(H,21,22)