2-[5-chloranyl-3-[(3-methyl-4-phenylmethoxy-phenyl)methyl]imidazol-4-yl]ethanenitrile

Systemtic Name: 2-[5-chloranyl-3-[(3-methyl-4-phenylmethoxy-phenyl)methyl]imidazol-4-yl]ethanenitrile Openeye Name: 2-[3-[(4-benzyloxy-3-methyl-phenyl)methyl]-5-chloro-imidazol-4-yl]acetonitrile CAS Name: 2-[5-chloro-3-[(3-methyl-4-phenylmethoxyphenyl)methyl]-4-imidazolyl]acetonitrile IUPAC Name: 2-[5-chloro-3-[(3-methyl-4-phenylmethoxyphenyl)methyl]imidazol-4-yl]acetonitrile Traditional Name: 2-[3-(4-benzoxy-3-methyl-benzyl)-5-chloro-imidazol-4-yl]acetonitrile Formula: C20H18ClN3O MolecularWeight: 351.82942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CN2C=NC(=C2CC#N)Cl)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)CN2C=NC(=C2CC#N)Cl)OCC3=CC=CC=C3

InChI

InChI=1S/C20H18ClN3O/c1-15-11-17(12-24-14-23-20(21)18(24)9-10-22)7-8-19(15)25-13-16-5-3-2-4-6-16/h2-8,11,14H,9,12-13H2,1H3