methyl 2-[(3aS,4R,7aS)-7a-methyl-1-oxidanylidene-3,3a,4,7-tetrahydro-2H-inden-4-yl]ethanoate

Systemtic Name: methyl 2-[(3aS,4R,7aS)-7a-methyl-1-oxidanylidene-3,3a,4,7-tetrahydro-2H-inden-4-yl]ethanoate Openeye Name: methyl 2-[(3aS,4R,7aS)-7a-methyl-1-oxo-3,3a,4,7-tetrahydro-2H-inden-4-yl]acetate CAS Name: 2-[(3aS,4R,7aS)-7a-methyl-1-oxo-3,3a,4,7-tetrahydro-2H-inden-4-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(3aS,4R,7aS)-7a-methyl-1-oxo-3,3a,4,7-tetrahydro-2H-inden-4-yl]acetate Traditional Name: 2-[(3aS,4R,7aS)-1-keto-7a-methyl-3,3a,4,7-tetrahydro-2H-inden-4-yl]acetic acid methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC=CC(C1CCC2=O)CC(=O)OC

Isomeric SMILES

C[C@]12CC=C[C@H]([C@@H]1CCC2=O)CC(=O)OC

InChI

InChI=1S/C13H18O3/c1-13-7-3-4-9(8-12(15)16-2)10(13)5-6-11(13)14/h3-4,9-10H,5-8H2,1-2H3/t9-,10-,13-/m0/s1