2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-(4-methoxyphenyl)amino]-N-(cyclohexylmethyl)ethanamide

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-(4-methoxyphenyl)amino]-N-(cyclohexylmethyl)ethanamide Openeye Name: 2-(N-(4-chloro-3-nitro-phenyl)sulfonyl-4-methoxy-anilino)-N-(cyclohexylmethyl)acetamide CAS Name: 2-(N-(4-chloro-3-nitrophenyl)sulfonyl-4-methoxyanilino)-N-(cyclohexylmethyl)acetamide IUPAC Name: 2-(N-(4-chloro-3-nitrophenyl)sulfonyl-4-methoxyanilino)-N-(cyclohexylmethyl)acetamide Traditional Name: 2-(N-(4-chloro-3-nitro-phenyl)sulfonyl-4-methoxy-anilino)-N-(cyclohexylmethyl)acetamide Formula: C22H26ClN3O6S MolecularWeight: 495.97634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)NCC2CCCCC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)NCC2CCCCC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H26ClN3O6S/c1-32-18-9-7-17(8-10-18)25(15-22(27)24-14-16-5-3-2-4-6-16)33(30,31)19-11-12-20(23)21(13-19)26(28)29/h7-13,16H,2-6,14-15H2,1H3,(H,24,27)