(4-methylcyclohexyl) 5-[3-(2-hydroxyethylamino)-3-oxidanylidene-propyl]-7-methoxy-1-benzofuran-3-carboxylate

Systemtic Name: (4-methylcyclohexyl) 5-[3-(2-hydroxyethylamino)-3-oxidanylidene-propyl]-7-methoxy-1-benzofuran-3-carboxylate Openeye Name: (4-methylcyclohexyl) 5-[3-(2-hydroxyethylamino)-3-oxo-propyl]-7-methoxy-benzofuran-3-carboxylate CAS Name: 5-[3-(2-hydroxyethylamino)-3-oxopropyl]-7-methoxy-3-benzofurancarboxylic acid (4-methylcyclohexyl) ester IUPAC Name: (4-methylcyclohexyl) 5-[3-(2-hydroxyethylamino)-3-oxopropyl]-7-methoxy-1-benzofuran-3-carboxylate Traditional Name: 5-[3-(2-hydroxyethylamino)-3-keto-propyl]-7-methoxy-benzofuran-3-carboxylic acid (4-methylcyclohexyl) ester Formula: C22H29NO6 MolecularWeight: 403.46876

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)OC(=O)C2=COC3=C(C=C(C=C23)CCC(=O)NCCO)OC

Isomeric SMILES

CC1CCC(CC1)OC(=O)C2=COC3=C(C=C(C=C23)CCC(=O)NCCO)OC

InChI

InChI=1S/C22H29NO6/c1-14-3-6-16(7-4-14)29-22(26)18-13-28-21-17(18)11-15(12-19(21)27-2)5-8-20(25)23-9-10-24/h11-14,16,24H,3-10H2,1-2H3,(H,23,25)