2-[(4-bromophenyl)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-yl)methyl]propanedinitrile

Systemtic Name: 2-[(4-bromophenyl)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-yl)methyl]propanedinitrile Openeye Name: 2-[(4-bromophenyl)-(3-methylene-5-oxo-1-phenyl-pyrazolidin-4-yl)methyl]propanedinitrile CAS Name: 2-[(4-bromophenyl)-(3-methylene-5-oxo-1-phenyl-4-pyrazolidinyl)methyl]propanedinitrile IUPAC Name: 2-[(4-bromophenyl)-(3-methylidene-5-oxo-1-phenylpyrazolidin-4-yl)methyl]propanedinitrile Traditional Name: 2-[(4-bromophenyl)-(5-keto-3-methylene-1-phenyl-pyrazolidin-4-yl)methyl]malononitrile Formula: C20H15BrN4O MolecularWeight: 407.2633

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CC=C(C=C3)Br)C(C#N)C#N

Isomeric SMILES

C=C1C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CC=C(C=C3)Br)C(C#N)C#N

InChI

InChI=1S/C20H15BrN4O/c1-13-18(20(26)25(24-13)17-5-3-2-4-6-17)19(15(11-22)12-23)14-7-9-16(21)10-8-14/h2-10,15,18-19,24H,1H2