3-methyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-nitro-benzamide

Systemtic Name: 3-methyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-nitro-benzamide Openeye Name: 3-methyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-nitro-benzamide CAS Name: 3-methyl-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-nitrobenzamide IUPAC Name: 3-methyl-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-nitrobenzamide Traditional Name: 3-methyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-nitro-benzamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C(=CC=C2)C)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C(=CC=C2)C)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H21N3O6S/c1-13-6-7-15(12-17(13)29(26,27)21-8-10-28-11-9-21)20-19(23)16-5-3-4-14(2)18(16)22(24)25/h3-7,12H,8-11H2,1-2H3,(H,20,23)