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3-octylsulfonyl-6-(quinolin-2-ylmethoxy)-2,3-dihydrochromen-4-one

3-octylsulfonyl-6-(quinolin-2-ylmethoxy)-2,3-dihydrochromen-4-one

Systemtic Name:3-octylsulfonyl-6-(quinolin-2-ylmethoxy)-2,3-dihydrochromen-4-one
Openeye Name:3-octylsulfonyl-6-(2-quinolylmethoxy)chroman-4-one
CAS Name:3-octylsulfonyl-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-4-one
IUPAC Name:3-octylsulfonyl-6-(quinolin-2-ylmethoxy)-2,3-dihydrochromen-4-one
Traditional Name:3-octylsulfonyl-6-(2-quinolylmethoxy)chroman-4-one
Formula: C27H31NO5S
MolecularWeight: 481.60374
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)C1COC2=C(C1=O)C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3


Isomeric SMILES

CCCCCCCCS(=O)(=O)C1COC2=C(C1=O)C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3


InChI

InChI=1S/C27H31NO5S/c1-2-3-4-5-6-9-16-34(30,31)26-19-33-25-15-14-22(17-23(25)27(26)29)32-18-21-13-12-20-10-7-8-11-24(20)28-21/h7-8,10-15,17,26H,2-6,9,16,18-19H2,1H3


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