4-(2-cyanoethyl)-4-(3,4-dichlorophenyl)carbonyl-heptanedinitrile

Systemtic Name: 4-(2-cyanoethyl)-4-(3,4-dichlorophenyl)carbonyl-heptanedinitrile Openeye Name: 4-(2-cyanoethyl)-4-(3,4-dichlorobenzoyl)heptanedinitrile CAS Name: 4-(2-cyanoethyl)-4-[(3,4-dichlorophenyl)-oxomethyl]heptanedinitrile IUPAC Name: 4-(2-cyanoethyl)-4-(3,4-dichlorobenzoyl)heptanedinitrile Traditional Name: 4-(2-cyanoethyl)-4-(3,4-dichlorobenzoyl)pimelonitrile Formula: C17H15Cl2N3O MolecularWeight: 348.2265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)C(CCC#N)(CCC#N)CCC#N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)C(CCC#N)(CCC#N)CCC#N)Cl)Cl

InChI

InChI=1S/C17H15Cl2N3O/c18-14-5-4-13(12-15(14)19)16(23)17(6-1-9-20,7-2-10-21)8-3-11-22/h4-5,12H,1-3,6-8H2