2-[(5aS,7R,9aS)-1-methanoyl-4-methoxy-7-oxidanyl-6,7-dihydro-5aH-dibenzofuran-9a-yl]ethanenitrile

Systemtic Name: 2-[(5aS,7R,9aS)-1-methanoyl-4-methoxy-7-oxidanyl-6,7-dihydro-5aH-dibenzofuran-9a-yl]ethanenitrile Openeye Name: 2-[(5aS,7R,9aS)-1-formyl-7-hydroxy-4-methoxy-6,7-dihydro-5aH-dibenzofuran-9a-yl]acetonitrile CAS Name: 2-[(5aS,7R,9aS)-1-formyl-7-hydroxy-4-methoxy-6,7-dihydro-5aH-dibenzofuran-9a-yl]acetonitrile IUPAC Name: 2-[(5aS,7R,9aS)-1-formyl-7-hydroxy-4-methoxy-6,7-dihydro-5aH-dibenzofuran-9a-yl]acetonitrile Traditional Name: 2-[(5aS,7R,9aS)-1-formyl-7-hydroxy-4-methoxy-6,7-dihydro-5aH-dibenzofuran-9a-yl]acetonitrile Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C=O)C3(C=CC(CC3O2)O)CC#N

Isomeric SMILES

COC1=C2C(=C(C=C1)C=O)[C@@]3(C=C[C@@H](C[C@@H]3O2)O)CC#N

InChI

InChI=1S/C16H15NO4/c1-20-12-3-2-10(9-18)14-15(12)21-13-8-11(19)4-5-16(13,14)6-7-17/h2-5,9,11,13,19H,6,8H2,1H3/t11-,13-,16-/m0/s1