3-decoxy-4-methoxy-7-[(2-methylpropan-2-yl)oxy]chromen-2-one

Systemtic Name: 3-decoxy-4-methoxy-7-[(2-methylpropan-2-yl)oxy]chromen-2-one Openeye Name: 7-tert-butoxy-3-decoxy-4-methoxy-chromen-2-one CAS Name: 3-decoxy-4-methoxy-7-[(2-methylpropan-2-yl)oxy]-1-benzopyran-2-one IUPAC Name: 3-decoxy-4-methoxy-7-[(2-methylpropan-2-yl)oxy]chromen-2-one Traditional Name: 7-tert-butoxy-3-decoxy-4-methoxy-coumarin Formula: C24H36O5 MolecularWeight: 404.53964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C2=C(C=C(C=C2)OC(C)(C)C)OC1=O)OC

Isomeric SMILES

CCCCCCCCCCOC1=C(C2=C(C=C(C=C2)OC(C)(C)C)OC1=O)OC

InChI

InChI=1S/C24H36O5/c1-6-7-8-9-10-11-12-13-16-27-22-21(26-5)19-15-14-18(29-24(2,3)4)17-20(19)28-23(22)25/h14-15,17H,6-13,16H2,1-5H3