2-[2-(4-chlorophenyl)sulfanyl-4-nitro-phenyl]ethanoic acid

Systemtic Name: 2-[2-(4-chlorophenyl)sulfanyl-4-nitro-phenyl]ethanoic acid Openeye Name: 2-[2-(4-chlorophenyl)sulfanyl-4-nitro-phenyl]acetic acid CAS Name: 2-[2-[(4-chlorophenyl)thio]-4-nitrophenyl]acetic acid IUPAC Name: 2-[2-(4-chlorophenyl)sulfanyl-4-nitrophenyl]acetic acid Traditional Name: 2-[2-[(4-chlorophenyl)thio]-4-nitro-phenyl]acetic acid Formula: C14H10ClNO4S MolecularWeight: 323.7515

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=C(C=CC(=C2)[N+](=O)[O-])CC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1SC2=C(C=CC(=C2)[N+](=O)[O-])CC(=O)O)Cl

InChI

InChI=1S/C14H10ClNO4S/c15-10-2-5-12(6-3-10)21-13-8-11(16(19)20)4-1-9(13)7-14(17)18/h1-6,8H,7H2,(H,17,18)