2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide Openeye Name: 2-(3,5-dimethyl-N-methylsulfonyl-anilino)-N-(2-methoxy-5-nitro-phenyl)propanamide CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-(2-methoxy-5-nitrophenyl)propanamide IUPAC Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-(2-methoxy-5-nitrophenyl)propanamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C(C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(C(C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)S(=O)(=O)C)C

InChI

InChI=1S/C19H23N3O6S/c1-12-8-13(2)10-16(9-12)21(29(5,26)27)14(3)19(23)20-17-11-15(22(24)25)6-7-18(17)28-4/h6-11,14H,1-5H3,(H,20,23)