N-(2-methyl-5-nitro-phenyl)-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-3-morpholinosulfonyl-benzamide CAS Name: N-(2-methyl-5-nitrophenyl)-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-3-morpholinosulfonyl-benzamide Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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