4-[3,4-bis(chloranyl)-2-formamido-phenyl]sulfanyl-3-nitro-benzoic acid

Systemtic Name: 4-[3,4-bis(chloranyl)-2-formamido-phenyl]sulfanyl-3-nitro-benzoic acid Openeye Name: 4-(3,4-dichloro-2-formamido-phenyl)sulfanyl-3-nitro-benzoic acid CAS Name: 4-[(3,4-dichloro-2-formamidophenyl)thio]-3-nitrobenzoic acid IUPAC Name: 4-(3,4-dichloro-2-formamidophenyl)sulfanyl-3-nitrobenzoic acid Traditional Name: 4-[(3,4-dichloro-2-formamido-phenyl)thio]-3-nitro-benzoic acid Formula: C14H8Cl2N2O5S MolecularWeight: 387.19472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])SC2=C(C(=C(C=C2)Cl)Cl)NC=O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])SC2=C(C(=C(C=C2)Cl)Cl)NC=O

InChI

InChI=1S/C14H8Cl2N2O5S/c15-8-2-4-11(13(12(8)16)17-6-19)24-10-3-1-7(14(20)21)5-9(10)18(22)23/h1-6H,(H,17,19)(H,20,21)