(E)-3-(3-bromanyl-4-phenylmethoxy-phenyl)-2-cyano-N-cyclopentyl-prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-4-phenylmethoxy-phenyl)-2-cyano-N-cyclopentyl-prop-2-enamide Openeye Name: (E)-3-(4-benzyloxy-3-bromo-phenyl)-2-cyano-N-cyclopentyl-prop-2-enamide CAS Name: (E)-3-(3-bromo-4-phenylmethoxyphenyl)-2-cyano-N-cyclopentyl-2-propenamide IUPAC Name: (E)-3-(3-bromo-4-phenylmethoxyphenyl)-2-cyano-N-cyclopentylprop-2-enamide Traditional Name: (E)-3-(4-benzoxy-3-bromo-phenyl)-2-cyano-N-cyclopentyl-acrylamide Formula: C22H21BrN2O2 MolecularWeight: 425.31834

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=CC=C3)Br)C#N

Isomeric SMILES

C1CCC(C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OCC3=CC=CC=C3)Br)/C#N

InChI

InChI=1S/C22H21BrN2O2/c23-20-13-17(10-11-21(20)27-15-16-6-2-1-3-7-16)12-18(14-24)22(26)25-19-8-4-5-9-19/h1-3,6-7,10-13,19H,4-5,8-9,15H2,(H,25,26)/b18-12+