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

Systemtic Name: N-(4-morpholin-4-ylsulfonylphenyl)-3-nitro-benzamide Openeye Name: N-(4-morpholinosulfonylphenyl)-3-nitro-benzamide CAS Name: N-[4-(4-morpholinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: N-(4-morpholin-4-ylsulfonylphenyl)-3-nitrobenzamide Traditional Name: N-(4-morpholinosulfonylphenyl)-3-nitro-benzamide Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6S/c21-17(13-2-1-3-15(12-13)20(22)23)18-14-4-6-16(7-5-14)27(24,25)19-8-10-26-11-9-19/h1-7,12H,8-11H2,(H,18,21)