methyl (1R,2R,3R)-3-methyl-1-(3-methylbutyl)-1,2-bis(oxidanyl)-4-oxidanylidene-3H-naphthalene-2-carboxylate

Systemtic Name: methyl (1R,2R,3R)-3-methyl-1-(3-methylbutyl)-1,2-bis(oxidanyl)-4-oxidanylidene-3H-naphthalene-2-carboxylate Openeye Name: methyl (1R,2R,3R)-1,2-dihydroxy-1-isopentyl-3-methyl-4-oxo-tetralin-2-carboxylate CAS Name: (1R,2R,3R)-1,2-dihydroxy-3-methyl-1-(3-methylbutyl)-4-oxo-3H-naphthalene-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,2R,3R)-1,2-dihydroxy-3-methyl-1-(3-methylbutyl)-4-oxo-3H-naphthalene-2-carboxylate Traditional Name: (1R,2R,3R)-1,2-dihydroxy-1-isoamyl-4-keto-3-methyl-tetralin-2-carboxylic acid methyl ester Formula: C18H24O5 MolecularWeight: 320.38016

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)C2=CC=CC=C2C(C1(C(=O)OC)O)(CCC(C)C)O

Isomeric SMILES

C[C@H]1C(=O)C2=CC=CC=C2[C@@]([C@]1(C(=O)OC)O)(CCC(C)C)O

InChI

InChI=1S/C18H24O5/c1-11(2)9-10-17(21)14-8-6-5-7-13(14)15(19)12(3)18(17,22)16(20)23-4/h5-8,11-12,21-22H,9-10H2,1-4H3/t12-,17+,18-/m0/s1