3-nitro-N-phenyl-4-(pyridin-3-ylmethylamino)benzenesulfonamide

Systemtic Name: 3-nitro-N-phenyl-4-(pyridin-3-ylmethylamino)benzenesulfonamide Openeye Name: 3-nitro-N-phenyl-4-(3-pyridylmethylamino)benzenesulfonamide CAS Name: 3-nitro-N-phenyl-4-(3-pyridinylmethylamino)benzenesulfonamide IUPAC Name: 3-nitro-N-phenyl-4-(pyridin-3-ylmethylamino)benzenesulfonamide Traditional Name: 3-nitro-N-phenyl-4-(3-pyridylmethylamino)benzenesulfonamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NCC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NCC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c23-22(24)18-11-16(27(25,26)21-15-6-2-1-3-7-15)8-9-17(18)20-13-14-5-4-10-19-12-14/h1-12,20-21H,13H2