3-(2-bromophenyl)-2-[(phenylmethyl)-[(E)-3-phenylprop-2-enyl]amino]propanenitrile

Systemtic Name: 3-(2-bromophenyl)-2-[(phenylmethyl)-[(E)-3-phenylprop-2-enyl]amino]propanenitrile Openeye Name: 2-[benzyl-[(E)-cinnamyl]amino]-3-(2-bromophenyl)propanenitrile CAS Name: 3-(2-bromophenyl)-2-[(phenylmethyl)-[(E)-3-phenylprop-2-enyl]amino]propanenitrile IUPAC Name: 2-[benzyl-[(E)-3-phenylprop-2-enyl]amino]-3-(2-bromophenyl)propanenitrile Traditional Name: 2-[benzyl-[(E)-cinnamyl]amino]-3-(2-bromophenyl)propionitrile Formula: C25H23BrN2 MolecularWeight: 431.36752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC=CC2=CC=CC=C2)C(CC3=CC=CC=C3Br)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN(C/C=C/C2=CC=CC=C2)C(CC3=CC=CC=C3Br)C#N

InChI

InChI=1S/C25H23BrN2/c26-25-16-8-7-15-23(25)18-24(19-27)28(20-22-12-5-2-6-13-22)17-9-14-21-10-3-1-4-11-21/h1-16,24H,17-18,20H2/b14-9+