N-[(4-morpholin-4-ylphenyl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(4-morpholin-4-ylphenyl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-[(4-morpholinophenyl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-[[4-(4-morpholinyl)phenyl]methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(4-morpholin-4-ylphenyl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-(4-morpholinobenzyl)-4-nitro-benzenesulfonamide Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O5S/c21-20(22)16-5-7-17(8-6-16)26(23,24)18-13-14-1-3-15(4-2-14)19-9-11-25-12-10-19/h1-8,18H,9-13H2