ethyl 2-(3-chloranylpropyl)-7-methoxy-5-[3-[(6-methyl-6-oxidanyl-heptan-2-yl)amino]-3-oxidanylidene-propyl]-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-(3-chloranylpropyl)-7-methoxy-5-[3-[(6-methyl-6-oxidanyl-heptan-2-yl)amino]-3-oxidanylidene-propyl]-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-(3-chloropropyl)-5-[3-[(5-hydroxy-1,5-dimethyl-hexyl)amino]-3-oxo-propyl]-7-methoxy-benzofuran-3-carboxylate CAS Name: 2-(3-chloropropyl)-5-[3-[(6-hydroxy-6-methylheptan-2-yl)amino]-3-oxopropyl]-7-methoxy-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-chloropropyl)-5-[3-[(6-hydroxy-6-methylheptan-2-yl)amino]-3-oxopropyl]-7-methoxy-1-benzofuran-3-carboxylate Traditional Name: 2-(3-chloropropyl)-5-[3-[(5-hydroxy-1,5-dimethyl-hexyl)amino]-3-keto-propyl]-7-methoxy-benzofuran-3-carboxylic acid ethyl ester Formula: C26H38ClNO6 MolecularWeight: 496.03602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C=C(C=C12)CCC(=O)NC(C)CCCC(C)(C)O)OC)CCCCl

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C=C(C=C12)CCC(=O)NC(C)CCCC(C)(C)O)OC)CCCCl

InChI

InChI=1S/C26H38ClNO6/c1-6-33-25(30)23-19-15-18(16-21(32-5)24(19)34-20(23)10-8-14-27)11-12-22(29)28-17(2)9-7-13-26(3,4)31/h15-17,31H,6-14H2,1-5H3,(H,28,29)