3-methyl-N-(4-morpholin-4-ylsulfonylphenyl)-2-nitro-benzamide

Systemtic Name: 3-methyl-N-(4-morpholin-4-ylsulfonylphenyl)-2-nitro-benzamide Openeye Name: 3-methyl-N-(4-morpholinosulfonylphenyl)-2-nitro-benzamide CAS Name: 3-methyl-N-[4-(4-morpholinylsulfonyl)phenyl]-2-nitrobenzamide IUPAC Name: 3-methyl-N-(4-morpholin-4-ylsulfonylphenyl)-2-nitrobenzamide Traditional Name: 3-methyl-N-(4-morpholinosulfonylphenyl)-2-nitro-benzamide Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H19N3O6S/c1-13-3-2-4-16(17(13)21(23)24)18(22)19-14-5-7-15(8-6-14)28(25,26)20-9-11-27-12-10-20/h2-8H,9-12H2,1H3,(H,19,22)