2-[4-(1-benzothiophen-3-ylcarbonyl)-3-(4-hydroxyphenyl)-5-oxidanyl-phenoxy]ethyl benzoate

Systemtic Name: 2-[4-(1-benzothiophen-3-ylcarbonyl)-3-(4-hydroxyphenyl)-5-oxidanyl-phenoxy]ethyl benzoate Openeye Name: 2-[4-(benzothiophene-3-carbonyl)-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]ethyl benzoate CAS Name: benzoic acid 2-[4-[1-benzothiophen-3-yl(oxo)methyl]-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]ethyl ester IUPAC Name: 2-[4-(1-benzothiophene-3-carbonyl)-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]ethyl benzoate Traditional Name: benzoic acid 2-[4-(benzothiophene-3-carbonyl)-3-hydroxy-5-(4-hydroxyphenyl)phenoxy]ethyl ester Formula: C30H22O6S MolecularWeight: 510.55708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCOC2=CC(=C(C(=C2)C3=CC=C(C=C3)O)C(=O)C4=CSC5=CC=CC=C54)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCOC2=CC(=C(C(=C2)C3=CC=C(C=C3)O)C(=O)C4=CSC5=CC=CC=C54)O

InChI

InChI=1S/C30H22O6S/c31-21-12-10-19(11-13-21)24-16-22(35-14-15-36-30(34)20-6-2-1-3-7-20)17-26(32)28(24)29(33)25-18-37-27-9-5-4-8-23(25)27/h1-13,16-18,31-32H,14-15H2