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

Systemtic Name: 2-[5-chloranyl-2-(3-methoxy-4-phenylmethoxy-phenyl)-3-(phenylmethyl)imidazol-4-yl]ethanenitrile Openeye Name: 2-[3-benzyl-2-(4-benzyloxy-3-methoxy-phenyl)-5-chloro-imidazol-4-yl]acetonitrile CAS Name: 2-[5-chloro-2-(3-methoxy-4-phenylmethoxyphenyl)-3-(phenylmethyl)-4-imidazolyl]acetonitrile IUPAC Name: 2-[3-benzyl-5-chloro-2-(3-methoxy-4-phenylmethoxyphenyl)imidazol-4-yl]acetonitrile Traditional Name: 2-[2-(4-benzoxy-3-methoxy-phenyl)-3-benzyl-5-chloro-imidazol-4-yl]acetonitrile Formula: C26H22ClN3O2 MolecularWeight: 443.92478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NC(=C(N2CC3=CC=CC=C3)CC#N)Cl)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NC(=C(N2CC3=CC=CC=C3)CC#N)Cl)OCC4=CC=CC=C4

InChI

InChI=1S/C26H22ClN3O2/c1-31-24-16-21(12-13-23(24)32-18-20-10-6-3-7-11-20)26-29-25(27)22(14-15-28)30(26)17-19-8-4-2-5-9-19/h2-13,16H,14,17-18H2,1H3