5,7-diethoxy-8-[(E)-2-methylbut-2-enoyl]-4-propyl-chromen-2-one

Systemtic Name: 5,7-diethoxy-8-[(E)-2-methylbut-2-enoyl]-4-propyl-chromen-2-one Openeye Name: 5,7-diethoxy-8-[(E)-2-methylbut-2-enoyl]-4-propyl-chromen-2-one CAS Name: 5,7-diethoxy-8-[(E)-2-methyl-1-oxobut-2-enyl]-4-propyl-1-benzopyran-2-one IUPAC Name: 5,7-diethoxy-8-[(E)-2-methylbut-2-enoyl]-4-propylchromen-2-one Traditional Name: 5,7-diethoxy-8-[(E)-2-methylbut-2-enoyl]-4-propyl-coumarin Formula: C21H26O5 MolecularWeight: 358.42814

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C(=CC(=C2C(=O)C(=CC)C)OCC)OCC

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C(=CC(=C2C(=O)/C(=C/C)/C)OCC)OCC

InChI

InChI=1S/C21H26O5/c1-6-10-14-11-17(22)26-21-18(14)15(24-8-3)12-16(25-9-4)19(21)20(23)13(5)7-2/h7,11-12H,6,8-10H2,1-5H3/b13-7+