[2-(4-hydroxyphenyl)-6-methoxy-1-benzothiophen-3-yl]-(4-pentoxyphenyl)methanone

Systemtic Name: [2-(4-hydroxyphenyl)-6-methoxy-1-benzothiophen-3-yl]-(4-pentoxyphenyl)methanone Openeye Name: [2-(4-hydroxyphenyl)-6-methoxy-benzothiophen-3-yl]-(4-pentoxyphenyl)methanone CAS Name: [2-(4-hydroxyphenyl)-6-methoxy-1-benzothiophen-3-yl]-(4-pentoxyphenyl)methanone IUPAC Name: [2-(4-hydroxyphenyl)-6-methoxy-1-benzothiophen-3-yl]-(4-pentoxyphenyl)methanone Traditional Name: (4-amoxyphenyl)-[2-(4-hydroxyphenyl)-6-methoxy-benzothiophen-3-yl]methanone Formula: C27H26O4S MolecularWeight: 446.55794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)C2=C(SC3=C2C=CC(=C3)OC)C4=CC=C(C=C4)O

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)C2=C(SC3=C2C=CC(=C3)OC)C4=CC=C(C=C4)O

InChI

InChI=1S/C27H26O4S/c1-3-4-5-16-31-21-12-8-18(9-13-21)26(29)25-23-15-14-22(30-2)17-24(23)32-27(25)19-6-10-20(28)11-7-19/h6-15,17,28H,3-5,16H2,1-2H3