methyl (2S,4S,4aS)-8-hex-1-ynyl-4-methyl-4-oxidanyl-2,3,4a,7-tetrahydro-1H-naphthalene-2-carboxylate

Systemtic Name: methyl (2S,4S,4aS)-8-hex-1-ynyl-4-methyl-4-oxidanyl-2,3,4a,7-tetrahydro-1H-naphthalene-2-carboxylate Openeye Name: methyl (2S,4S,4aS)-8-hex-1-ynyl-4-hydroxy-4-methyl-2,3,4a,7-tetrahydro-1H-naphthalene-2-carboxylate CAS Name: (2S,4S,4aS)-8-hex-1-ynyl-4-hydroxy-4-methyl-2,3,4a,7-tetrahydro-1H-naphthalene-2-carboxylic acid methyl ester IUPAC Name: methyl (2S,4S,4aS)-8-hex-1-ynyl-4-hydroxy-4-methyl-2,3,4a,7-tetrahydro-1H-naphthalene-2-carboxylate Traditional Name: (2S,4S,4aS)-8-hex-1-ynyl-4-hydroxy-4-methyl-2,3,4a,7-tetrahydro-1H-naphthalene-2-carboxylic acid methyl ester Formula: C19H26O3 MolecularWeight: 302.40794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C2CC(CC(C2C=CC1)(C)O)C(=O)OC

Isomeric SMILES

CCCCC#CC1=C2C[C@@H](C[C@]([C@H]2C=CC1)(C)O)C(=O)OC

InChI

InChI=1S/C19H26O3/c1-4-5-6-7-9-14-10-8-11-17-16(14)12-15(18(20)22-3)13-19(17,2)21/h8,11,15,17,21H,4-6,10,12-13H2,1-3H3/t15-,17-,19-/m0/s1