4-[3-[4-(imidazol-1-ylmethyl)-2-oxidanylidene-piperidin-1-yl]phenoxy]benzenecarbonitrile

Systemtic Name: 4-[3-[4-(imidazol-1-ylmethyl)-2-oxidanylidene-piperidin-1-yl]phenoxy]benzenecarbonitrile Openeye Name: 4-[3-[4-(imidazol-1-ylmethyl)-2-oxo-1-piperidyl]phenoxy]benzonitrile CAS Name: 4-[3-[4-(1-imidazolylmethyl)-2-oxo-1-piperidinyl]phenoxy]benzonitrile IUPAC Name: 4-[3-[4-(imidazol-1-ylmethyl)-2-oxopiperidin-1-yl]phenoxy]benzonitrile Traditional Name: 4-[3-[4-(imidazol-1-ylmethyl)-2-keto-piperidino]phenoxy]benzonitrile Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CC1CN2C=CN=C2)C3=CC(=CC=C3)OC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(C(=O)CC1CN2C=CN=C2)C3=CC(=CC=C3)OC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H20N4O2/c23-14-17-4-6-20(7-5-17)28-21-3-1-2-19(13-21)26-10-8-18(12-22(26)27)15-25-11-9-24-16-25/h1-7,9,11,13,16,18H,8,10,12,15H2