3-(1,3-benzodioxol-5-yl)-4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]benzenecarbonitrile

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]benzenecarbonitrile Openeye Name: 3-(1,3-benzodioxol-5-yl)-4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]benzonitrile CAS Name: 3-(1,3-benzodioxol-5-yl)-4-[[(4-cyanophenyl)-(3-methyl-4-imidazolyl)methoxy]methyl]benzonitrile IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]benzonitrile Traditional Name: 3-(1,3-benzodioxol-5-yl)-4-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]benzonitrile Formula: C27H20N4O3 MolecularWeight: 448.4727

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)OCC3=C(C=C(C=C3)C#N)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)OCC3=C(C=C(C=C3)C#N)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H20N4O3/c1-31-16-30-14-24(31)27(20-5-2-18(12-28)3-6-20)32-15-22-7-4-19(13-29)10-23(22)21-8-9-25-26(11-21)34-17-33-25/h2-11,14,16,27H,15,17H2,1H3