4-decoxy-3,5-bis[(E)-hex-3-enoxy]chromen-2-one

Systemtic Name: 4-decoxy-3,5-bis[(E)-hex-3-enoxy]chromen-2-one Openeye Name: 4-decoxy-3,5-bis[(E)-hex-3-enoxy]chromen-2-one CAS Name: 4-decoxy-3,5-bis[(E)-hex-3-enoxy]-1-benzopyran-2-one IUPAC Name: 4-decoxy-3,5-bis[(E)-hex-3-enoxy]chromen-2-one Traditional Name: 4-decoxy-3,5-bis[(E)-hex-3-enoxy]coumarin Formula: C31H46O5 MolecularWeight: 498.69394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H46O5/c1-4-7-10-13-14-15-16-19-24-34-29-28-26(33-23-17-11-8-5-2)21-20-22-27(28)36-31(32)30(29)35-25-18-12-9-6-3/h8-9,11-12,20-22H,4-7,10,13-19,23-25H2,1-3H3/b11-8+,12-9+