N-[(2-morpholin-4-ylpyridin-3-yl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(2-morpholin-4-ylpyridin-3-yl)methyl]-4-nitro-benzenesulfonamide Openeye Name: N-[(2-morpholino-3-pyridyl)methyl]-4-nitro-benzenesulfonamide CAS Name: N-[[2-(4-morpholinyl)-3-pyridinyl]methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(2-morpholin-4-ylpyridin-3-yl)methyl]-4-nitrobenzenesulfonamide Traditional Name: N-[(2-morpholino-3-pyridyl)methyl]-4-nitro-benzenesulfonamide Formula: C16H18N4O5S MolecularWeight: 378.40292

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC=N2)CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=CC=N2)CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O5S/c21-20(22)14-3-5-15(6-4-14)26(23,24)18-12-13-2-1-7-17-16(13)19-8-10-25-11-9-19/h1-7,18H,8-12H2