2-methyl-N-(3-morpholin-4-ylpropyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-methyl-N-(3-morpholin-4-ylpropyl)-5-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-(3-morpholinopropyl)-5-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[3-(4-morpholinyl)propyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-(3-morpholin-4-ylpropyl)-5-nitrobenzenesulfonamide Traditional Name: 2-methyl-N-(3-morpholinopropyl)-5-nitro-benzenesulfonamide Formula: C14H21N3O5S MolecularWeight: 343.39864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCN2CCOCC2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCN2CCOCC2

InChI

InChI=1S/C14H21N3O5S/c1-12-3-4-13(17(18)19)11-14(12)23(20,21)15-5-2-6-16-7-9-22-10-8-16/h3-4,11,15H,2,5-10H2,1H3