4-methyl-N-[2,2,2-tris(chloranyl)-1-(4-nitrophenyl)sulfanyl-ethyl]benzamide

Systemtic Name: 4-methyl-N-[2,2,2-tris(chloranyl)-1-(4-nitrophenyl)sulfanyl-ethyl]benzamide Openeye Name: 4-methyl-N-[2,2,2-trichloro-1-(4-nitrophenyl)sulfanyl-ethyl]benzamide CAS Name: 4-methyl-N-[2,2,2-trichloro-1-[(4-nitrophenyl)thio]ethyl]benzamide IUPAC Name: 4-methyl-N-[2,2,2-trichloro-1-(4-nitrophenyl)sulfanylethyl]benzamide Traditional Name: 4-methyl-N-[2,2,2-trichloro-1-[(4-nitrophenyl)thio]ethyl]benzamide Formula: C16H13Cl3N2O3S MolecularWeight: 419.71002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13Cl3N2O3S/c1-10-2-4-11(5-3-10)14(22)20-15(16(17,18)19)25-13-8-6-12(7-9-13)21(23)24/h2-9,15H,1H3,(H,20,22)