(3S)-8-(methoxymethoxy)-3-[(1R)-3-methyl-1-oxidanyl-butyl]-3,4-dihydroisochromen-1-one

Systemtic Name: (3S)-8-(methoxymethoxy)-3-[(1R)-3-methyl-1-oxidanyl-butyl]-3,4-dihydroisochromen-1-one Openeye Name: (3S)-3-[(1R)-1-hydroxy-3-methyl-butyl]-8-(methoxymethoxy)isochroman-1-one CAS Name: (3S)-3-[(1R)-1-hydroxy-3-methylbutyl]-8-(methoxymethoxy)-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (3S)-3-[(1R)-1-hydroxy-3-methylbutyl]-8-(methoxymethoxy)-3,4-dihydroisochromen-1-one Traditional Name: (3S)-3-[(1R)-1-hydroxy-3-methyl-butyl]-8-(methoxymethoxy)isochroman-1-one Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1CC2=C(C(=CC=C2)OCOC)C(=O)O1)O

Isomeric SMILES

CC(C)C[C@H]([C@@H]1CC2=C(C(=CC=C2)OCOC)C(=O)O1)O

InChI

InChI=1S/C16H22O5/c1-10(2)7-12(17)14-8-11-5-4-6-13(20-9-19-3)15(11)16(18)21-14/h4-6,10,12,14,17H,7-9H2,1-3H3/t12-,14+/m1/s1