2-[4-[(4-bromophenyl)carbamoyl]-2-nitro-phenyl]sulfanylethanoic acid

Systemtic Name: 2-[4-[(4-bromophenyl)carbamoyl]-2-nitro-phenyl]sulfanylethanoic acid Openeye Name: 2-[4-[(4-bromophenyl)carbamoyl]-2-nitro-phenyl]sulfanylacetic acid CAS Name: 2-[[4-[(4-bromoanilino)-oxomethyl]-2-nitrophenyl]thio]acetic acid IUPAC Name: 2-[4-[(4-bromophenyl)carbamoyl]-2-nitrophenyl]sulfanylacetic acid Traditional Name: 2-[[4-[(4-bromophenyl)carbamoyl]-2-nitro-phenyl]thio]acetic acid Formula: C15H11BrN2O5S MolecularWeight: 411.22724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=CC(=C(C=C2)SCC(=O)O)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=CC(=C(C=C2)SCC(=O)O)[N+](=O)[O-])Br

InChI

InChI=1S/C15H11BrN2O5S/c16-10-2-4-11(5-3-10)17-15(21)9-1-6-13(24-8-14(19)20)12(7-9)18(22)23/h1-7H,8H2,(H,17,21)(H,19,20)