4-methoxy-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)-3-nitro-benzamide

Systemtic Name: 4-methoxy-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)-3-nitro-benzamide Openeye Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-4-methoxy-3-nitro-benzamide CAS Name: 4-methoxy-N-[5-(4-morpholinylsulfonyl)-2-propan-2-yloxyphenyl]-3-nitrobenzamide IUPAC Name: 4-methoxy-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyphenyl)-3-nitrobenzamide Traditional Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-4-methoxy-3-nitro-benzamide Formula: C21H25N3O8S MolecularWeight: 479.5035

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O8S/c1-14(2)32-19-7-5-16(33(28,29)23-8-10-31-11-9-23)13-17(19)22-21(25)15-4-6-20(30-3)18(12-15)24(26)27/h4-7,12-14H,8-11H2,1-3H3,(H,22,25)