(3aS,6aS)-6a-but-3-enyl-3-methylidene-4-oxidanylidene-1,2,5,6-tetrahydropentalene-3a-carbonitrile

Systemtic Name: (3aS,6aS)-6a-but-3-enyl-3-methylidene-4-oxidanylidene-1,2,5,6-tetrahydropentalene-3a-carbonitrile Openeye Name: (3aS,6aS)-6a-but-3-enyl-3-methylene-4-oxo-1,2,5,6-tetrahydropentalene-3a-carbonitrile CAS Name: (3aS,6aS)-6a-but-3-enyl-3-methylene-4-oxo-1,2,5,6-tetrahydropentalene-3a-carbonitrile IUPAC Name: (3aS,6aS)-6a-but-3-enyl-3-methylidene-4-oxo-1,2,5,6-tetrahydropentalene-3a-carbonitrile Traditional Name: (3aS,6aS)-6a-but-3-enyl-3-keto-4-methylene-1,2,5,6-tetrahydropentalene-3a-carbonitrile Formula: C14H17NO MolecularWeight: 215.29088

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC12CCC(=C)C1(C(=O)CC2)C#N

Isomeric SMILES

C=CCC[C@@]12CCC(=C)[C@@]1(C(=O)CC2)C#N

InChI

InChI=1S/C14H17NO/c1-3-4-7-13-8-5-11(2)14(13,10-15)12(16)6-9-13/h3H,1-2,4-9H2/t13-,14+/m0/s1