(4aS,9aS)-1-methoxy-9a-methyl-9-oxidanylidene-7,8-dihydro-4aH-benzo[7]annulene-4-carbonitrile

Systemtic Name: (4aS,9aS)-1-methoxy-9a-methyl-9-oxidanylidene-7,8-dihydro-4aH-benzo[7]annulene-4-carbonitrile Openeye Name: (4aS,9aS)-1-methoxy-9a-methyl-9-oxo-7,8-dihydro-4aH-benzo[7]annulene-4-carbonitrile CAS Name: (4aS,9aS)-1-methoxy-9a-methyl-9-oxo-7,8-dihydro-4aH-benzo[7]annulene-4-carbonitrile IUPAC Name: (4aS,9aS)-1-methoxy-9a-methyl-9-oxo-7,8-dihydro-4aH-benzo[7]annulene-4-carbonitrile Traditional Name: (4aS,9aS)-9-keto-1-methoxy-9a-methyl-7,8-dihydro-4aH-benzocycloheptene-4-carbonitrile Formula: C14H15NO2 MolecularWeight: 229.2744

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Descriptors Computed from Structure

Canonical SMILES:

CC12C(C=CCCC1=O)C(=CC=C2OC)C#N

Isomeric SMILES

C[C@@]12[C@@H](C=CCCC1=O)C(=CC=C2OC)C#N

InChI

InChI=1S/C14H15NO2/c1-14-11(5-3-4-6-12(14)16)10(9-15)7-8-13(14)17-2/h3,5,7-8,11H,4,6H2,1-2H3/t11-,14+/m0/s1