4-[3-[1-methoxy-8-(methylsulfonylamino)-6H-benzo[c]chromen-6-yl]phenyl]butanoic acid

Systemtic Name: 4-[3-[1-methoxy-8-(methylsulfonylamino)-6H-benzo[c]chromen-6-yl]phenyl]butanoic acid Openeye Name: 4-[3-[8-(methanesulfonamido)-1-methoxy-6H-benzo[c]chromen-6-yl]phenyl]butanoic acid CAS Name: 4-[3-[8-(methanesulfonamido)-1-methoxy-6H-benzo[c][1]benzopyran-6-yl]phenyl]butanoic acid IUPAC Name: 4-[3-[8-(methanesulfonamido)-1-methoxy-6H-benzo[c]chromen-6-yl]phenyl]butanoic acid Traditional Name: 4-[3-[8-(methanesulfonamido)-1-methoxy-6H-benzo[c]chromen-6-yl]phenyl]butyric acid Formula: C25H25NO6S MolecularWeight: 467.5341

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C3=C(C=C(C=C3)NS(=O)(=O)C)C(O2)C4=CC(=CC=C4)CCCC(=O)O

Isomeric SMILES

COC1=CC=CC2=C1C3=C(C=C(C=C3)NS(=O)(=O)C)C(O2)C4=CC(=CC=C4)CCCC(=O)O

InChI

InChI=1S/C25H25NO6S/c1-31-21-9-5-10-22-24(21)19-13-12-18(26-33(2,29)30)15-20(19)25(32-22)17-8-3-6-16(14-17)7-4-11-23(27)28/h3,5-6,8-10,12-15,25-26H,4,7,11H2,1-2H3,(H,27,28)