sodium (4-bromanyl-2-methyl-phenyl)carbonyl-[(E)-2-(3-chlorophenyl)ethenyl]sulfonyl-azanide

Systemtic Name: sodium (4-bromanyl-2-methyl-phenyl)carbonyl-[(E)-2-(3-chlorophenyl)ethenyl]sulfonyl-azanide Openeye Name: sodium (4-bromo-2-methyl-benzoyl)-[(E)-2-(3-chlorophenyl)vinyl]sulfonyl-azanide CAS Name: sodium [(4-bromo-2-methylphenyl)-oxomethyl]-[(E)-2-(3-chlorophenyl)ethenyl]sulfonylazanide IUPAC Name: sodium (4-bromo-2-methylbenzoyl)-[(E)-2-(3-chlorophenyl)ethenyl]sulfonylazanide Traditional Name: sodium (4-bromo-2-methyl-benzoyl)-[(E)-2-(3-chlorophenyl)vinyl]sulfonyl-azanide Formula: C16H12BrClNNaO3S MolecularWeight: 436.68315

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)C(=O)[N-]S(=O)(=O)C=CC2=CC(=CC=C2)Cl.[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)C(=O)[N-]S(=O)(=O)/C=C/C2=CC(=CC=C2)Cl.[Na+]

InChI

InChI=1S/C16H13BrClNO3S.Na/c1-11-9-13(17)5-6-15(11)16(20)19-23(21,22)8-7-12-3-2-4-14(18)10-12;/h2-10H,1H3,(H,19,20);/q;+1/p-1/b8-7+;