4-decoxy-7-[(E)-hex-3-enoxy]-3-oxidanyl-chromen-2-one

Systemtic Name: 4-decoxy-7-[(E)-hex-3-enoxy]-3-oxidanyl-chromen-2-one Openeye Name: 4-decoxy-7-[(E)-hex-3-enoxy]-3-hydroxy-chromen-2-one CAS Name: 4-decoxy-7-[(E)-hex-3-enoxy]-3-hydroxy-1-benzopyran-2-one IUPAC Name: 4-decoxy-7-[(E)-hex-3-enoxy]-3-hydroxychromen-2-one Traditional Name: 4-decoxy-7-[(E)-hex-3-enoxy]-3-hydroxy-coumarin Formula: C25H36O5 MolecularWeight: 416.55034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C(=O)OC2=C1C=CC(=C2)OCCC=CCC)O

Isomeric SMILES

CCCCCCCCCCOC1=C(C(=O)OC2=C1C=CC(=C2)OCC/C=C/CC)O

InChI

InChI=1S/C25H36O5/c1-3-5-7-9-10-11-12-14-18-29-24-21-16-15-20(28-17-13-8-6-4-2)19-22(21)30-25(27)23(24)26/h6,8,15-16,19,26H,3-5,7,9-14,17-18H2,1-2H3/b8-6+