7-butyl-6,8-bis(oxidanyl)-3-pentyl-3,4-dihydroisochromen-1-one

Systemtic Name: 7-butyl-6,8-bis(oxidanyl)-3-pentyl-3,4-dihydroisochromen-1-one Openeye Name: 7-butyl-6,8-dihydroxy-3-pentyl-isochroman-1-one CAS Name: 7-butyl-6,8-dihydroxy-3-pentyl-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 7-butyl-6,8-dihydroxy-3-pentyl-3,4-dihydroisochromen-1-one Traditional Name: 3-amyl-7-butyl-6,8-dihydroxy-isochroman-1-one Formula: C18H26O4 MolecularWeight: 306.39664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC2=CC(=C(C(=C2C(=O)O1)O)CCCC)O

Isomeric SMILES

CCCCCC1CC2=CC(=C(C(=C2C(=O)O1)O)CCCC)O

InChI

InChI=1S/C18H26O4/c1-3-5-7-8-13-10-12-11-15(19)14(9-6-4-2)17(20)16(12)18(21)22-13/h11,13,19-20H,3-10H2,1-2H3