methyl (8S,8aS)-3,4,6,7,8,8a-hexahydro-2H-chromene-8-carboxylate

Systemtic Name: methyl (8S,8aS)-3,4,6,7,8,8a-hexahydro-2H-chromene-8-carboxylate Openeye Name: methyl (8S,8aS)-3,4,6,7,8,8a-hexahydro-2H-chromene-8-carboxylate CAS Name: (8S,8aS)-3,4,6,7,8,8a-hexahydro-2H-1-benzopyran-8-carboxylic acid methyl ester IUPAC Name: methyl (8S,8aS)-3,4,6,7,8,8a-hexahydro-2H-chromene-8-carboxylate Traditional Name: (8S,8aS)-3,4,6,7,8,8a-hexahydro-2H-chromene-8-carboxylic acid methyl ester Formula: C11H16O3 MolecularWeight: 196.24294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC=C2C1OCCC2

Isomeric SMILES

COC(=O)[C@H]1CCC=C2[C@H]1OCCC2

InChI

InChI=1S/C11H16O3/c1-13-11(12)9-6-2-4-8-5-3-7-14-10(8)9/h4,9-10H,2-3,5-7H2,1H3/t9-,10+/m0/s1