4-(imidazol-1-ylmethyl)-2-[(8-oxidanylidene-6,7-dihydro-5H-naphthalen-1-yl)oxy]benzenecarbonitrile

Systemtic Name: 4-(imidazol-1-ylmethyl)-2-[(8-oxidanylidene-6,7-dihydro-5H-naphthalen-1-yl)oxy]benzenecarbonitrile Openeye Name: 4-(imidazol-1-ylmethyl)-2-(4-oxotetralin-5-yl)oxy-benzonitrile CAS Name: 4-(1-imidazolylmethyl)-2-[(8-oxo-6,7-dihydro-5H-naphthalen-1-yl)oxy]benzonitrile IUPAC Name: 4-(imidazol-1-ylmethyl)-2-[(8-oxo-6,7-dihydro-5H-naphthalen-1-yl)oxy]benzonitrile Traditional Name: 4-(imidazol-1-ylmethyl)-2-(4-ketotetralin-5-yl)oxy-benzonitrile Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)C(=CC=C2)OC3=C(C=CC(=C3)CN4C=CN=C4)C#N

Isomeric SMILES

C1CC2=C(C(=O)C1)C(=CC=C2)OC3=C(C=CC(=C3)CN4C=CN=C4)C#N

InChI

InChI=1S/C21H17N3O2/c22-12-17-8-7-15(13-24-10-9-23-14-24)11-20(17)26-19-6-2-4-16-3-1-5-18(25)21(16)19/h2,4,6-11,14H,1,3,5,13H2