4-[4-[(2,4-dichlorophenyl)-oxidanyl-methyl]-1H-pyrrol-3-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[(2,4-dichlorophenyl)-oxidanyl-methyl]-1H-pyrrol-3-yl]benzenecarbonitrile Openeye Name: 4-[4-[(2,4-dichlorophenyl)-hydroxy-methyl]-1H-pyrrol-3-yl]benzonitrile CAS Name: 4-[4-[(2,4-dichlorophenyl)-hydroxymethyl]-1H-pyrrol-3-yl]benzonitrile IUPAC Name: 4-[4-[(2,4-dichlorophenyl)-hydroxymethyl]-1H-pyrrol-3-yl]benzonitrile Traditional Name: 4-[4-[(2,4-dichlorophenyl)-hydroxy-methyl]-1H-pyrrol-3-yl]benzonitrile Formula: C18H12Cl2N2O MolecularWeight: 343.20668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=CNC=C2C(C3=C(C=C(C=C3)Cl)Cl)O

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=CNC=C2C(C3=C(C=C(C=C3)Cl)Cl)O

InChI

InChI=1S/C18H12Cl2N2O/c19-13-5-6-14(17(20)7-13)18(23)16-10-22-9-15(16)12-3-1-11(8-21)2-4-12/h1-7,9-10,18,22-23H