(4aR,8aS)-4a-ethyl-3-methyl-1-oxidanylidene-7,8-dihydro-6H-isochromene-5,5,8a-tricarbonitrile

Systemtic Name: (4aR,8aS)-4a-ethyl-3-methyl-1-oxidanylidene-7,8-dihydro-6H-isochromene-5,5,8a-tricarbonitrile Openeye Name: (4aR,8aS)-4a-ethyl-3-methyl-1-oxo-7,8-dihydro-6H-isochromene-5,5,8a-tricarbonitrile CAS Name: (4aR,8aS)-4a-ethyl-3-methyl-1-oxo-7,8-dihydro-6H-2-benzopyran-5,5,8a-tricarbonitrile IUPAC Name: (4aR,8aS)-4a-ethyl-3-methyl-1-oxo-7,8-dihydro-6H-isochromene-5,5,8a-tricarbonitrile Traditional Name: (4aR,8aS)-4a-ethyl-1-keto-3-methyl-7,8-dihydro-6H-isochromene-5,5,8a-tricarbonitrile Formula: C15H15N3O2 MolecularWeight: 269.2985

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Descriptors Computed from Structure

Canonical SMILES:

CCC12C=C(OC(=O)C1(CCCC2(C#N)C#N)C#N)C

Isomeric SMILES

CC[C@]12C=C(OC(=O)[C@]1(CCCC2(C#N)C#N)C#N)C

InChI

InChI=1S/C15H15N3O2/c1-3-15-7-11(2)20-12(19)14(15,10-18)6-4-5-13(15,8-16)9-17/h7H,3-6H2,1-2H3/t14-,15+/m0/s1