4-[3,5-bis(chloranyl)-4-cyclohexyloxy-phenoxy]-3-oxidanylidene-2-pyrrol-1-ylcarbonyl-butanenitrile

Systemtic Name: 4-[3,5-bis(chloranyl)-4-cyclohexyloxy-phenoxy]-3-oxidanylidene-2-pyrrol-1-ylcarbonyl-butanenitrile Openeye Name: 4-[3,5-dichloro-4-(cyclohexoxy)phenoxy]-3-oxo-2-(pyrrole-1-carbonyl)butanenitrile CAS Name: 4-(3,5-dichloro-4-cyclohexyloxyphenoxy)-3-oxo-2-[oxo(1-pyrrolyl)methyl]butanenitrile IUPAC Name: 4-(3,5-dichloro-4-cyclohexyloxyphenoxy)-3-oxo-2-(pyrrole-1-carbonyl)butanenitrile Traditional Name: 4-[3,5-dichloro-4-(cyclohexoxy)phenoxy]-3-keto-2-(pyrrole-1-carbonyl)butyronitrile Formula: C21H20Cl2N2O4 MolecularWeight: 435.3005

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=C(C=C(C=C2Cl)OCC(=O)C(C#N)C(=O)N3C=CC=C3)Cl

Isomeric SMILES

C1CCC(CC1)OC2=C(C=C(C=C2Cl)OCC(=O)C(C#N)C(=O)N3C=CC=C3)Cl

InChI

InChI=1S/C21H20Cl2N2O4/c22-17-10-15(11-18(23)20(17)29-14-6-2-1-3-7-14)28-13-19(26)16(12-24)21(27)25-8-4-5-9-25/h4-5,8-11,14,16H,1-3,6-7,13H2