4-[[5-[[2-(1,3-benzodioxol-5-yl)-4-cyano-phenyl]methoxymethyl]imidazol-1-yl]methyl]-3-naphthalen-1-yl-benzenecarbonitrile

Systemtic Name: 4-[[5-[[2-(1,3-benzodioxol-5-yl)-4-cyano-phenyl]methoxymethyl]imidazol-1-yl]methyl]-3-naphthalen-1-yl-benzenecarbonitrile Openeye Name: 4-[[5-[[2-(1,3-benzodioxol-5-yl)-4-cyano-phenyl]methoxymethyl]imidazol-1-yl]methyl]-3-(1-naphthyl)benzonitrile CAS Name: 4-[[5-[[2-(1,3-benzodioxol-5-yl)-4-cyanophenyl]methoxymethyl]-1-imidazolyl]methyl]-3-(1-naphthalenyl)benzonitrile IUPAC Name: 4-[[5-[[2-(1,3-benzodioxol-5-yl)-4-cyanophenyl]methoxymethyl]imidazol-1-yl]methyl]-3-naphthalen-1-ylbenzonitrile Traditional Name: 4-[[5-[[2-(1,3-benzodioxol-5-yl)-4-cyano-benzyl]oxymethyl]imidazol-1-yl]methyl]-3-(1-naphthyl)benzonitrile Formula: C37H26N4O3 MolecularWeight: 574.62734

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(C=CC(=C3)C#N)COCC4=CN=CN4CC5=C(C=C(C=C5)C#N)C6=CC=CC7=CC=CC=C76

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(C=CC(=C3)C#N)COCC4=CN=CN4CC5=C(C=C(C=C5)C#N)C6=CC=CC7=CC=CC=C76

InChI

InChI=1S/C37H26N4O3/c38-17-25-9-11-30(34(14-25)28-12-13-36-37(16-28)44-24-43-36)21-42-22-31-19-40-23-41(31)20-29-10-8-26(18-39)15-35(29)33-7-3-5-27-4-1-2-6-32(27)33/h1-16,19,23H,20-22,24H2