3-chloranyl-5-methoxy-4-(2-methylpropoxy)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]benzamide

Systemtic Name: 3-chloranyl-5-methoxy-4-(2-methylpropoxy)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]benzamide Openeye Name: 3-chloro-4-isobutoxy-5-methoxy-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]benzamide CAS Name: 3-chloro-5-methoxy-4-(2-methylpropoxy)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]benzamide IUPAC Name: 3-chloro-5-methoxy-4-(2-methylpropoxy)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]benzamide Traditional Name: 3-chloro-4-isobutoxy-N-[2-(4-mesyl-2-nitro-anilino)ethyl]-5-methoxy-benzamide Formula: C21H26ClN3O7S MolecularWeight: 499.96504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1Cl)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1Cl)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])OC

InChI

InChI=1S/C21H26ClN3O7S/c1-13(2)12-32-20-16(22)9-14(10-19(20)31-3)21(26)24-8-7-23-17-6-5-15(33(4,29)30)11-18(17)25(27)28/h5-6,9-11,13,23H,7-8,12H2,1-4H3,(H,24,26)