4-butyl-1-(2-tert-butyl-5-chloranyl-phenyl)-5-methylidene-2-oxidanylidene-pyrrole-3-carbonitrile

Systemtic Name: 4-butyl-1-(2-tert-butyl-5-chloranyl-phenyl)-5-methylidene-2-oxidanylidene-pyrrole-3-carbonitrile Openeye Name: 4-butyl-1-(2-tert-butyl-5-chloro-phenyl)-5-methylene-2-oxo-pyrrole-3-carbonitrile CAS Name: 4-butyl-1-(2-tert-butyl-5-chlorophenyl)-5-methylene-2-oxo-3-pyrrolecarbonitrile IUPAC Name: 4-butyl-1-(2-tert-butyl-5-chlorophenyl)-5-methylidene-2-oxopyrrole-3-carbonitrile Traditional Name: 4-butyl-1-(2-tert-butyl-5-chloro-phenyl)-2-keto-5-methylene-3-pyrroline-3-carbonitrile Formula: C20H23ClN2O MolecularWeight: 342.86242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N(C1=C)C2=C(C=CC(=C2)Cl)C(C)(C)C)C#N

Isomeric SMILES

CCCCC1=C(C(=O)N(C1=C)C2=C(C=CC(=C2)Cl)C(C)(C)C)C#N

InChI

InChI=1S/C20H23ClN2O/c1-6-7-8-15-13(2)23(19(24)16(15)12-22)18-11-14(21)9-10-17(18)20(3,4)5/h9-11H,2,6-8H2,1,3-5H3