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

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-4-morpholino-3-nitro-benzamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-4-morpholino-3-nitro-benzamide Formula: C22H26N4O7S MolecularWeight: 490.52944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H26N4O7S/c1-16-2-4-18(15-21(16)34(30,31)25-8-12-33-13-9-25)23-22(27)17-3-5-19(20(14-17)26(28)29)24-6-10-32-11-7-24/h2-5,14-15H,6-13H2,1H3,(H,23,27)