5-decoxy-3-oxidanyl-4-propan-2-yloxy-chromen-2-one

Systemtic Name: 5-decoxy-3-oxidanyl-4-propan-2-yloxy-chromen-2-one Openeye Name: 5-decoxy-3-hydroxy-4-isopropoxy-chromen-2-one CAS Name: 5-decoxy-3-hydroxy-4-propan-2-yloxy-1-benzopyran-2-one IUPAC Name: 5-decoxy-3-hydroxy-4-propan-2-yloxychromen-2-one Traditional Name: 5-decoxy-3-hydroxy-4-isopropoxy-coumarin Formula: C22H32O5 MolecularWeight: 376.48648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=CC2=C1C(=C(C(=O)O2)O)OC(C)C

Isomeric SMILES

CCCCCCCCCCOC1=CC=CC2=C1C(=C(C(=O)O2)O)OC(C)C

InChI

InChI=1S/C22H32O5/c1-4-5-6-7-8-9-10-11-15-25-17-13-12-14-18-19(17)21(26-16(2)3)20(23)22(24)27-18/h12-14,16,23H,4-11,15H2,1-3H3