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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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