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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-14-6-7-15(12-17(14)22(24)25)19(23)20-13-16-4-2-3-5-18(16)29(26,27)21-8-10-28-11-9-21/h2-7,12H,8-11,13H2,1H3,(H,20,23)