(3S,3aR)-3-methyl-3-(2-methylpropyl)-1-oxidanyl-4,5,6,7-tetrahydro-3aH-inden-2-one

Systemtic Name: (3S,3aR)-3-methyl-3-(2-methylpropyl)-1-oxidanyl-4,5,6,7-tetrahydro-3aH-inden-2-one Openeye Name: (3S,3aR)-1-hydroxy-3-isobutyl-3-methyl-4,5,6,7-tetrahydro-3aH-inden-2-one CAS Name: (3S,3aR)-1-hydroxy-3-methyl-3-(2-methylpropyl)-4,5,6,7-tetrahydro-3aH-inden-2-one IUPAC Name: (3S,3aR)-1-hydroxy-3-methyl-3-(2-methylpropyl)-4,5,6,7-tetrahydro-3aH-inden-2-one Traditional Name: (3S,3aR)-1-hydroxy-3-isobutyl-3-methyl-4,5,6,7-tetrahydro-3aH-inden-2-one Formula: C14H22O2 MolecularWeight: 222.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(C2CCCCC2=C(C1=O)O)C

Isomeric SMILES

CC(C)C[C@]1([C@@H]2CCCCC2=C(C1=O)O)C

InChI

InChI=1S/C14H22O2/c1-9(2)8-14(3)11-7-5-4-6-10(11)12(15)13(14)16/h9,11,15H,4-8H2,1-3H3/t11-,14+/m1/s1