2-[(2-chloranyl-5-nitro-phenyl)sulfonyl-(2-methoxyphenyl)amino]-N-cycloheptyl-ethanamide

Systemtic Name: 2-[(2-chloranyl-5-nitro-phenyl)sulfonyl-(2-methoxyphenyl)amino]-N-cycloheptyl-ethanamide Openeye Name: 2-(N-(2-chloro-5-nitro-phenyl)sulfonyl-2-methoxy-anilino)-N-cycloheptyl-acetamide CAS Name: 2-(N-(2-chloro-5-nitrophenyl)sulfonyl-2-methoxyanilino)-N-cycloheptylacetamide IUPAC Name: 2-(N-(2-chloro-5-nitrophenyl)sulfonyl-2-methoxyanilino)-N-cycloheptylacetamide Traditional Name: 2-(N-(2-chloro-5-nitro-phenyl)sulfonyl-2-methoxy-anilino)-N-cycloheptyl-acetamide Formula: C22H26ClN3O6S MolecularWeight: 495.97634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(CC(=O)NC2CCCCCC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=CC=C1N(CC(=O)NC2CCCCCC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H26ClN3O6S/c1-32-20-11-7-6-10-19(20)25(15-22(27)24-16-8-4-2-3-5-9-16)33(30,31)21-14-17(26(28)29)12-13-18(21)23/h6-7,10-14,16H,2-5,8-9,15H2,1H3,(H,24,27)