2-[2-(2-imidazol-1-yl-1-phenyl-ethoxy)-5-oxidanylidene-7,8-dihydro-6H-naphthalen-1-yl]benzenecarbonitrile

Systemtic Name: 2-[2-(2-imidazol-1-yl-1-phenyl-ethoxy)-5-oxidanylidene-7,8-dihydro-6H-naphthalen-1-yl]benzenecarbonitrile Openeye Name: 2-[6-(2-imidazol-1-yl-1-phenyl-ethoxy)-1-oxo-tetralin-5-yl]benzonitrile CAS Name: 2-[2-[2-(1-imidazolyl)-1-phenylethoxy]-5-oxo-7,8-dihydro-6H-naphthalen-1-yl]benzonitrile IUPAC Name: 2-[2-(2-imidazol-1-yl-1-phenylethoxy)-5-oxo-7,8-dihydro-6H-naphthalen-1-yl]benzonitrile Traditional Name: 2-[6-(2-imidazol-1-yl-1-phenyl-ethoxy)-1-keto-tetralin-5-yl]benzonitrile Formula: C28H23N3O2 MolecularWeight: 433.50112

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2C3=CC=CC=C3C#N)OC(CN4C=CN=C4)C5=CC=CC=C5)C(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2C3=CC=CC=C3C#N)OC(CN4C=CN=C4)C5=CC=CC=C5)C(=O)C1

InChI

InChI=1S/C28H23N3O2/c29-17-21-9-4-5-10-22(21)28-24-11-6-12-25(32)23(24)13-14-26(28)33-27(18-31-16-15-30-19-31)20-7-2-1-3-8-20/h1-5,7-10,13-16,19,27H,6,11-12,18H2