4-[(1S,2R)-6,7-dimethoxy-1-(phenylcarbonyl)-1,2-dihydronaphthalen-2-yl]benzenecarbonitrile

Systemtic Name: 4-[(1S,2R)-6,7-dimethoxy-1-(phenylcarbonyl)-1,2-dihydronaphthalen-2-yl]benzenecarbonitrile Openeye Name: 4-[(1S,2R)-1-benzoyl-6,7-dimethoxy-1,2-dihydronaphthalen-2-yl]benzonitrile CAS Name: 4-[(1S,2R)-1-benzoyl-6,7-dimethoxy-1,2-dihydronaphthalen-2-yl]benzonitrile IUPAC Name: 4-[(1S,2R)-1-benzoyl-6,7-dimethoxy-1,2-dihydronaphthalen-2-yl]benzonitrile Traditional Name: 4-[(1S,2R)-1-benzoyl-6,7-dimethoxy-1,2-dihydronaphthalen-2-yl]benzonitrile Formula: C26H21NO3 MolecularWeight: 395.44984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(C(C=CC2=C1)C3=CC=C(C=C3)C#N)C(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2[C@H]([C@@H](C=CC2=C1)C3=CC=C(C=C3)C#N)C(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H21NO3/c1-29-23-14-20-12-13-21(18-10-8-17(16-27)9-11-18)25(22(20)15-24(23)30-2)26(28)19-6-4-3-5-7-19/h3-15,21,25H,1-2H3/t21-,25-/m0/s1