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

Systemtic Name: (4-methylcyclohexyl) 5-[3-(2-hydroxyethylamino)-3-oxidanylidene-propyl]-7-methoxy-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: (4-methylcyclohexyl) 5-[3-(2-hydroxyethylamino)-3-oxo-propyl]-7-methoxy-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[3-(2-hydroxyethylamino)-3-oxopropyl]-7-methoxy-2-phenyl-3-benzofurancarboxylic acid (4-methylcyclohexyl) ester IUPAC Name: (4-methylcyclohexyl) 5-[3-(2-hydroxyethylamino)-3-oxopropyl]-7-methoxy-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[3-(2-hydroxyethylamino)-3-keto-propyl]-7-methoxy-2-phenyl-benzofuran-3-carboxylic acid (4-methylcyclohexyl) ester Formula: C28H33NO6 MolecularWeight: 479.56472

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)OC(=O)C2=C(OC3=C(C=C(C=C23)CCC(=O)NCCO)OC)C4=CC=CC=C4

Isomeric SMILES

CC1CCC(CC1)OC(=O)C2=C(OC3=C(C=C(C=C23)CCC(=O)NCCO)OC)C4=CC=CC=C4

InChI

InChI=1S/C28H33NO6/c1-18-8-11-21(12-9-18)34-28(32)25-22-16-19(10-13-24(31)29-14-15-30)17-23(33-2)27(22)35-26(25)20-6-4-3-5-7-20/h3-7,16-18,21,30H,8-15H2,1-2H3,(H,29,31)