N-(2-nitro-3-propyl-phenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide

Systemtic Name: N-(2-nitro-3-propyl-phenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide Openeye Name: N-(2-nitro-3-propyl-phenyl)-N-(3-pyridylmethyl)methanesulfonamide CAS Name: N-(2-nitro-3-propylphenyl)-N-(3-pyridinylmethyl)methanesulfonamide IUPAC Name: N-(2-nitro-3-propylphenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide Traditional Name: N-(2-nitro-3-propyl-phenyl)-N-(3-pyridylmethyl)methanesulfonamide Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC=C1)N(CC2=CN=CC=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(C(=CC=C1)N(CC2=CN=CC=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O4S/c1-3-6-14-8-4-9-15(16(14)19(20)21)18(24(2,22)23)12-13-7-5-10-17-11-13/h4-5,7-11H,3,6,12H2,1-2H3