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

Systemtic Name: 7-decoxy-3,4-bis[(E)-hex-3-enoxy]chromen-2-one Openeye Name: 7-decoxy-3,4-bis[(E)-hex-3-enoxy]chromen-2-one CAS Name: 7-decoxy-3,4-bis[(E)-hex-3-enoxy]-1-benzopyran-2-one IUPAC Name: 7-decoxy-3,4-bis[(E)-hex-3-enoxy]chromen-2-one Traditional Name: 7-decoxy-3,4-bis[(E)-hex-3-enoxy]coumarin Formula: C31H46O5 MolecularWeight: 498.69394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)OCCC=CCC)OCCC=CCC

Isomeric SMILES

CCCCCCCCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)OCC/C=C/CC)OCC/C=C/CC

InChI

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