7-oxidanylidene-4b-(phenylmethyl)-5,6,8,8a,9,10-hexahydrophenanthrene-2-carbonitrile

Systemtic Name: 7-oxidanylidene-4b-(phenylmethyl)-5,6,8,8a,9,10-hexahydrophenanthrene-2-carbonitrile Openeye Name: 4b-benzyl-7-oxo-5,6,8,8a,9,10-hexahydrophenanthrene-2-carbonitrile CAS Name: 7-oxo-4b-(phenylmethyl)-5,6,8,8a,9,10-hexahydrophenanthrene-2-carbonitrile IUPAC Name: 4b-benzyl-7-oxo-5,6,8,8a,9,10-hexahydrophenanthrene-2-carbonitrile Traditional Name: 4b-benzyl-7-keto-5,6,8,8a,9,10-hexahydrophenanthrene-2-carbonitrile Formula: C22H21NO MolecularWeight: 315.40824

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C#N)C3(C1CC(=O)CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C=CC(=C2)C#N)C3(C1CC(=O)CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H21NO/c23-15-17-6-9-21-18(12-17)7-8-19-13-20(24)10-11-22(19,21)14-16-4-2-1-3-5-16/h1-6,9,12,19H,7-8,10-11,13-14H2