[4-[(E)-2-cyano-2-(phenylsulfonyl)ethenyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [4-[(E)-2-cyano-2-(phenylsulfonyl)ethenyl]phenyl] 4-chloranylbenzoate Openeye Name: [4-[(E)-2-(benzenesulfonyl)-2-cyano-vinyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-(benzenesulfonyl)-2-cyanoethenyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-[(E)-2-besyl-2-cyano-vinyl]phenyl] ester Formula: C22H14ClNO4S MolecularWeight: 423.86886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Cl)/C#N

InChI

InChI=1S/C22H14ClNO4S/c23-18-10-8-17(9-11-18)22(25)28-19-12-6-16(7-13-19)14-21(15-24)29(26,27)20-4-2-1-3-5-20/h1-14H/b21-14+