11-(1H-imidazol-2-yl)-2-(2-methoxy-4-methyl-phenyl)-2-phenyl-undecanenitrile

Systemtic Name: 11-(1H-imidazol-2-yl)-2-(2-methoxy-4-methyl-phenyl)-2-phenyl-undecanenitrile Openeye Name: 11-(1H-imidazol-2-yl)-2-(2-methoxy-4-methyl-phenyl)-2-phenyl-undecanenitrile CAS Name: 11-(1H-imidazol-2-yl)-2-(2-methoxy-4-methylphenyl)-2-phenylundecanenitrile IUPAC Name: 11-(1H-imidazol-2-yl)-2-(2-methoxy-4-methylphenyl)-2-phenylundecanenitrile Traditional Name: 11-(1H-imidazol-2-yl)-2-(2-methoxy-4-methyl-phenyl)-2-phenyl-undecanenitrile Formula: C28H35N3O MolecularWeight: 429.597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(CCCCCCCCCC2=NC=CN2)(C#N)C3=CC=CC=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C(CCCCCCCCCC2=NC=CN2)(C#N)C3=CC=CC=C3)OC

InChI

InChI=1S/C28H35N3O/c1-23-16-17-25(26(21-23)32-2)28(22-29,24-13-9-8-10-14-24)18-12-7-5-3-4-6-11-15-27-30-19-20-31-27/h8-10,13-14,16-17,19-21H,3-7,11-12,15,18H2,1-2H3,(H,30,31)