3-acetamido-2-(2-bromophenyl)sulfanyl-4-chloranyl-benzoic acid

Systemtic Name: 3-acetamido-2-(2-bromophenyl)sulfanyl-4-chloranyl-benzoic acid Openeye Name: 3-acetamido-2-(2-bromophenyl)sulfanyl-4-chloro-benzoic acid CAS Name: 3-acetamido-2-[(2-bromophenyl)thio]-4-chlorobenzoic acid IUPAC Name: 3-acetamido-2-(2-bromophenyl)sulfanyl-4-chlorobenzoic acid Traditional Name: 3-acetamido-2-[(2-bromophenyl)thio]-4-chloro-benzoic acid Formula: C15H11BrClNO3S MolecularWeight: 400.67474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1SC2=CC=CC=C2Br)C(=O)O)Cl

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1SC2=CC=CC=C2Br)C(=O)O)Cl

InChI

InChI=1S/C15H11BrClNO3S/c1-8(19)18-13-11(17)7-6-9(15(20)21)14(13)22-12-5-3-2-4-10(12)16/h2-7H,1H3,(H,18,19)(H,20,21)