(E)-3-[4-[(3-bromophenyl)methoxy]phenyl]-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: (E)-3-[4-[(3-bromophenyl)methoxy]phenyl]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: (E)-2-(benzenesulfonyl)-3-[4-[(3-bromophenyl)methoxy]phenyl]prop-2-enenitrile CAS Name: (E)-2-(benzenesulfonyl)-3-[4-[(3-bromophenyl)methoxy]phenyl]-2-propenenitrile IUPAC Name: (E)-2-(benzenesulfonyl)-3-[4-[(3-bromophenyl)methoxy]phenyl]prop-2-enenitrile Traditional Name: (E)-2-besyl-3-[4-(3-bromobenzyl)oxyphenyl]acrylonitrile Formula: C22H16BrNO3S MolecularWeight: 454.33634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16BrNO3S/c23-19-6-4-5-18(13-19)16-27-20-11-9-17(10-12-20)14-22(15-24)28(25,26)21-7-2-1-3-8-21/h1-14H,16H2/b22-14+