1-[7-ethanoyl-4,6-bis(oxidanyl)-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[7-ethanoyl-4,6-bis(oxidanyl)-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-yl]-3-methyl-butan-1-one Openeye Name: 1-(7-acetyl-4,6-dihydroxy-2-isopropenyl-2,3-dihydrobenzofuran-5-yl)-3-methyl-butan-1-one CAS Name: 1-[7-acetyl-4,6-dihydroxy-2-(1-methylethenyl)-2,3-dihydrobenzofuran-5-yl]-3-methyl-1-butanone IUPAC Name: 1-(7-acetyl-4,6-dihydroxy-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-yl)-3-methylbutan-1-one Traditional Name: 1-(7-acetyl-4,6-dihydroxy-2-isopropenyl-coumaran-5-yl)-3-methyl-butan-1-one Formula: C18H22O5 MolecularWeight: 318.36428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C1=C(C(=C2C(=C1O)CC(O2)C(=C)C)C(=O)C)O

Isomeric SMILES

CC(C)CC(=O)C1=C(C(=C2C(=C1O)CC(O2)C(=C)C)C(=O)C)O

InChI

InChI=1S/C18H22O5/c1-8(2)6-12(20)15-16(21)11-7-13(9(3)4)23-18(11)14(10(5)19)17(15)22/h8,13,21-22H,3,6-7H2,1-2,4-5H3