methyl (1S,4aR,5S)-1,4a-dimethyl-6-methylidene-5-(2-oxidanylideneethyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

Systemtic Name: methyl (1S,4aR,5S)-1,4a-dimethyl-6-methylidene-5-(2-oxidanylideneethyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate Openeye Name: methyl (1S,4aR,5S)-1,4a-dimethyl-6-methylene-5-(2-oxoethyl)decalin-1-carboxylate CAS Name: (1S,4aR,5S)-1,4a-dimethyl-6-methylene-5-(2-oxoethyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid methyl ester IUPAC Name: methyl (1S,4aR,5S)-1,4a-dimethyl-6-methylidene-5-(2-oxoethyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate Traditional Name: (1S,4aR,5S)-5-(2-ketoethyl)-1,4a-dimethyl-6-methylene-decalin-1-carboxylic acid methyl ester Formula: C17H26O3 MolecularWeight: 278.38654

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCCC(C1CCC(=C)C2CC=O)(C)C(=O)OC

Isomeric SMILES

C[C@]12CCC[C@](C1CCC(=C)[C@@H]2CC=O)(C)C(=O)OC

InChI

InChI=1S/C17H26O3/c1-12-6-7-14-16(2,13(12)8-11-18)9-5-10-17(14,3)15(19)20-4/h11,13-14H,1,5-10H2,2-4H3/t13-,14?,16+,17-/m0/s1