(3S,3aS,6aR)-3-methoxy-3-methyl-2,3a,6,6a-tetrahydropentalen-1-one

Systemtic Name: (3S,3aS,6aR)-3-methoxy-3-methyl-2,3a,6,6a-tetrahydropentalen-1-one Openeye Name: (3S,3aS,6aR)-3-methoxy-3-methyl-2,3a,6,6a-tetrahydropentalen-1-one CAS Name: (3S,3aS,6aR)-3-methoxy-3-methyl-2,3a,6,6a-tetrahydropentalen-1-one IUPAC Name: (3S,3aS,6aR)-3-methoxy-3-methyl-2,3a,6,6a-tetrahydropentalen-1-one Traditional Name: (3S,3aS,6aR)-3-methoxy-3-methyl-2,3a,6,6a-tetrahydropentalen-1-one Formula: C10H14O2 MolecularWeight: 166.21696

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2C1C=CC2)OC

Isomeric SMILES

C[C@@]1(CC(=O)[C@H]2[C@@H]1C=CC2)OC

InChI

InChI=1S/C10H14O2/c1-10(12-2)6-9(11)7-4-3-5-8(7)10/h3,5,7-8H,4,6H2,1-2H3/t7-,8+,10+/m1/s1