3-[(3,4-dimethylphenyl)sulfonylamino]-N-(2-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(2-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(2-methyl-3-nitro-phenyl)propanamide CAS Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(2-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(2-methyl-3-nitrophenyl)propanamide Traditional Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(2-methyl-3-nitro-phenyl)propionamide Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O5S/c1-12-7-8-15(11-13(12)2)27(25,26)19-10-9-18(22)20-16-5-4-6-17(14(16)3)21(23)24/h4-8,11,19H,9-10H2,1-3H3,(H,20,22)