4-(6-chloranyl-2-formamido-3-methyl-phenyl)sulfanyl-3-nitro-benzoic acid

Systemtic Name: 4-(6-chloranyl-2-formamido-3-methyl-phenyl)sulfanyl-3-nitro-benzoic acid Openeye Name: 4-(6-chloro-2-formamido-3-methyl-phenyl)sulfanyl-3-nitro-benzoic acid CAS Name: 4-[(6-chloro-2-formamido-3-methylphenyl)thio]-3-nitrobenzoic acid IUPAC Name: 4-(6-chloro-2-formamido-3-methylphenyl)sulfanyl-3-nitrobenzoic acid Traditional Name: 4-[(6-chloro-2-formamido-3-methyl-phenyl)thio]-3-nitro-benzoic acid Formula: C15H11ClN2O5S MolecularWeight: 366.77624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)SC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-])NC=O

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)SC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-])NC=O

InChI

InChI=1S/C15H11ClN2O5S/c1-8-2-4-10(16)14(13(8)17-7-19)24-12-5-3-9(15(20)21)6-11(12)18(22)23/h2-7H,1H3,(H,17,19)(H,20,21)