N-[(2R)-2-morpholin-4-yl-2-pyridin-3-yl-ethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(2R)-2-morpholin-4-yl-2-pyridin-3-yl-ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[(2R)-2-morpholino-2-(3-pyridyl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[(2R)-2-(4-morpholinyl)-2-(3-pyridinyl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[(2R)-2-morpholino-2-(3-pyridyl)ethyl]-4-nitro-benzenesulfonamide Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CN=CC=C3

Isomeric SMILES

C1COCCN1[C@@H](CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CN=CC=C3

InChI

InChI=1S/C17H20N4O5S/c22-21(23)15-3-5-16(6-4-15)27(24,25)19-13-17(14-2-1-7-18-12-14)20-8-10-26-11-9-20/h1-7,12,17,19H,8-11,13H2/t17-/m0/s1