(12S,13S)-13-oxidanyl-6,11,12,13-tetrahydrobenzo[c][1]benzoxonine-12-carbonitrile

Systemtic Name: (12S,13S)-13-oxidanyl-6,11,12,13-tetrahydrobenzo[c][1]benzoxonine-12-carbonitrile Openeye Name: (12S,13S)-13-hydroxy-6,11,12,13-tetrahydrobenzo[c][1]benzoxonine-12-carbonitrile CAS Name: (12S,13S)-13-hydroxy-6,11,12,13-tetrahydrobenzo[c][1]benzoxonin-12-carbonitrile IUPAC Name: (12S,13S)-13-hydroxy-6,11,12,13-tetrahydrobenzo[c][1]benzoxonine-12-carbonitrile Traditional Name: (12S,13S)-13-hydroxy-6,11,12,13-tetrahydrobenzo[c][1]benzoxonin-12-carbonitrile Formula: C17H15NO2 MolecularWeight: 265.3065

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=CC=CC=C2OCC3=CC=CC=C31)O)C#N

Isomeric SMILES

C1[C@H]([C@@H](C2=CC=CC=C2OCC3=CC=CC=C31)O)C#N

InChI

InChI=1S/C17H15NO2/c18-10-14-9-12-5-1-2-6-13(12)11-20-16-8-4-3-7-15(16)17(14)19/h1-8,14,17,19H,9,11H2/t14-,17-/m0/s1