4-[4-(4-bromanylphenoxy)phenoxy]-3-oxidanylidene-2-pyrrolidin-1-ylcarbonyl-pentanenitrile

Systemtic Name: 4-[4-(4-bromanylphenoxy)phenoxy]-3-oxidanylidene-2-pyrrolidin-1-ylcarbonyl-pentanenitrile Openeye Name: 4-[4-(4-bromophenoxy)phenoxy]-3-oxo-2-(pyrrolidine-1-carbonyl)pentanenitrile CAS Name: 4-[4-(4-bromophenoxy)phenoxy]-3-oxo-2-[oxo(1-pyrrolidinyl)methyl]pentanenitrile IUPAC Name: 4-[4-(4-bromophenoxy)phenoxy]-3-oxo-2-(pyrrolidine-1-carbonyl)pentanenitrile Traditional Name: 4-[4-(4-bromophenoxy)phenoxy]-3-keto-2-(pyrrolidine-1-carbonyl)valeronitrile Formula: C22H21BrN2O4 MolecularWeight: 457.31714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C#N)C(=O)N1CCCC1)OC2=CC=C(C=C2)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C(=O)C(C#N)C(=O)N1CCCC1)OC2=CC=C(C=C2)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H21BrN2O4/c1-15(21(26)20(14-24)22(27)25-12-2-3-13-25)28-17-8-10-19(11-9-17)29-18-6-4-16(23)5-7-18/h4-11,15,20H,2-3,12-13H2,1H3