1-[4-[(10bR,10cR)-10b,10c-dimethylpyren-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[(10bR,10cR)-10b,10c-dimethylpyren-1-yl]phenyl]ethanone Openeye Name: 1-[4-[(10bR,10cR)-10b,10c-dimethylpyren-1-yl]phenyl]ethanone CAS Name: 1-[4-[(10bR,10cR)-10b,10c-dimethyl-1-pyrenyl]phenyl]ethanone IUPAC Name: 1-[4-[(10bR,10cR)-10b,10c-dimethylpyren-1-yl]phenyl]ethanone Traditional Name: 1-[4-[(10bR,10cR)-10b,10c-dimethylpyren-1-yl]phenyl]ethanone Formula: C26H22O MolecularWeight: 350.45228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=C3C=CC4=CC=CC5=CC=C(C3(C54C)C)C=C2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=C3C=CC4=CC=CC5=CC=C([C@]3([C@]54C)C)C=C2

InChI

InChI=1S/C26H22O/c1-17(27)18-7-9-19(10-8-18)23-15-13-22-12-11-20-5-4-6-21-14-16-24(23)26(22,3)25(20,21)2/h4-16H,1-3H3/t25-,26-/m1/s1