3-decoxy-4-methoxy-5-[(2-methylpropan-2-yl)oxy]chromen-2-one

Systemtic Name: 3-decoxy-4-methoxy-5-[(2-methylpropan-2-yl)oxy]chromen-2-one Openeye Name: 5-tert-butoxy-3-decoxy-4-methoxy-chromen-2-one CAS Name: 3-decoxy-4-methoxy-5-[(2-methylpropan-2-yl)oxy]-1-benzopyran-2-one IUPAC Name: 3-decoxy-4-methoxy-5-[(2-methylpropan-2-yl)oxy]chromen-2-one Traditional Name: 5-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=CC=C2OC(C)(C)C)OC1=O)OC

Isomeric SMILES

CCCCCCCCCCOC1=C(C2=C(C=CC=C2OC(C)(C)C)OC1=O)OC

InChI

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