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

Systemtic Name: 2-[3-(3-ethyl-1-methyl-2-oxidanylidene-piperidin-3-yl)phenoxy]-4-(imidazol-1-ylmethyl)benzenecarbonitrile Openeye Name: 2-[3-(3-ethyl-1-methyl-2-oxo-3-piperidyl)phenoxy]-4-(imidazol-1-ylmethyl)benzonitrile CAS Name: 2-[3-(3-ethyl-1-methyl-2-oxo-3-piperidinyl)phenoxy]-4-(1-imidazolylmethyl)benzonitrile IUPAC Name: 2-[3-(3-ethyl-1-methyl-2-oxopiperidin-3-yl)phenoxy]-4-(imidazol-1-ylmethyl)benzonitrile Traditional Name: 2-[3-(3-ethyl-2-keto-1-methyl-3-piperidyl)phenoxy]-4-(imidazol-1-ylmethyl)benzonitrile Formula: C25H26N4O2 MolecularWeight: 414.49954

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCN(C1=O)C)C2=CC(=CC=C2)OC3=C(C=CC(=C3)CN4C=CN=C4)C#N

Isomeric SMILES

CCC1(CCCN(C1=O)C)C2=CC(=CC=C2)OC3=C(C=CC(=C3)CN4C=CN=C4)C#N

InChI

InChI=1S/C25H26N4O2/c1-3-25(10-5-12-28(2)24(25)30)21-6-4-7-22(15-21)31-23-14-19(8-9-20(23)16-26)17-29-13-11-27-18-29/h4,6-9,11,13-15,18H,3,5,10,12,17H2,1-2H3