4-[2-[[2-(2-chloranylphenoxy)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[[2-(2-chloranylphenoxy)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-[2-(2-chlorophenoxy)anilino]-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-[2-(2-chlorophenoxy)anilino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-[2-(2-chlorophenoxy)anilino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-[2-(2-chlorophenoxy)anilino]-2-keto-ethyl]thio]-3-nitro-benzamide Formula: C21H16ClN3O5S MolecularWeight: 457.88684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC3=CC=CC=C3Cl

InChI

InChI=1S/C21H16ClN3O5S/c22-14-5-1-3-7-17(14)30-18-8-4-2-6-15(18)24-20(26)12-31-19-10-9-13(21(23)27)11-16(19)25(28)29/h1-11H,12H2,(H2,23,27)(H,24,26)