5-[(2S,4S)-2,4-bis(oxidanyl)hept-6-enyl]-2,2-dimethyl-1,3-benzodioxin-4-one

Systemtic Name: 5-[(2S,4S)-2,4-bis(oxidanyl)hept-6-enyl]-2,2-dimethyl-1,3-benzodioxin-4-one Openeye Name: 5-[(2S,4S)-2,4-dihydroxyhept-6-enyl]-2,2-dimethyl-1,3-benzodioxin-4-one CAS Name: 5-[(2S,4S)-2,4-dihydroxyhept-6-enyl]-2,2-dimethyl-1,3-benzodioxin-4-one IUPAC Name: 5-[(2S,4S)-2,4-dihydroxyhept-6-enyl]-2,2-dimethyl-1,3-benzodioxin-4-one Traditional Name: 5-[(2S,4S)-2,4-dihydroxyhept-6-enyl]-2,2-dimethyl-1,3-benzodioxin-4-one Formula: C17H22O5 MolecularWeight: 306.35358

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=CC=CC(=C2C(=O)O1)CC(CC(CC=C)O)O)C

Isomeric SMILES

CC1(OC2=CC=CC(=C2C(=O)O1)C[C@@H](C[C@H](CC=C)O)O)C

InChI

InChI=1S/C17H22O5/c1-4-6-12(18)10-13(19)9-11-7-5-8-14-15(11)16(20)22-17(2,3)21-14/h4-5,7-8,12-13,18-19H,1,6,9-10H2,2-3H3/t12-,13-/m0/s1