methyl 2-methoxy-7-[3-(2-phenethyl-5-phenylmethoxy-3H-1-benzofuran-2-yl)propylsulfanyl]quinoline-3-carboxylate

Systemtic Name: methyl 2-methoxy-7-[3-(2-phenethyl-5-phenylmethoxy-3H-1-benzofuran-2-yl)propylsulfanyl]quinoline-3-carboxylate Openeye Name: methyl 7-[3-(5-benzyloxy-2-phenethyl-3H-benzofuran-2-yl)propylsulfanyl]-2-methoxy-quinoline-3-carboxylate CAS Name: 2-methoxy-7-[3-(2-phenethyl-5-phenylmethoxy-3H-benzofuran-2-yl)propylthio]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-methoxy-7-[3-(2-phenethyl-5-phenylmethoxy-3H-1-benzofuran-2-yl)propylsulfanyl]quinoline-3-carboxylate Traditional Name: 7-[3-(5-benzoxy-2-phenethyl-coumaran-2-yl)propylthio]-2-methoxy-quinoline-3-carboxylic acid methyl ester Formula: C38H37NO5S MolecularWeight: 619.76908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=CC(=CC2=N1)SCCCC3(CC4=C(O3)C=CC(=C4)OCC5=CC=CC=C5)CCC6=CC=CC=C6)C(=O)OC

Isomeric SMILES

COC1=C(C=C2C=CC(=CC2=N1)SCCCC3(CC4=C(O3)C=CC(=C4)OCC5=CC=CC=C5)CCC6=CC=CC=C6)C(=O)OC

InChI

InChI=1S/C38H37NO5S/c1-41-36-33(37(40)42-2)23-29-14-16-32(24-34(29)39-36)45-21-9-19-38(20-18-27-10-5-3-6-11-27)25-30-22-31(15-17-35(30)44-38)43-26-28-12-7-4-8-13-28/h3-8,10-17,22-24H,9,18-21,25-26H2,1-2H3