N-(cyanomethyl)-1-(3-nitrophenyl)-N-(2-propoxypropyl)methanesulfonamide

Systemtic Name: N-(cyanomethyl)-1-(3-nitrophenyl)-N-(2-propoxypropyl)methanesulfonamide Openeye Name: N-(cyanomethyl)-1-(3-nitrophenyl)-N-(2-propoxypropyl)methanesulfonamide CAS Name: N-(cyanomethyl)-1-(3-nitrophenyl)-N-(2-propoxypropyl)methanesulfonamide IUPAC Name: N-(cyanomethyl)-1-(3-nitrophenyl)-N-(2-propoxypropyl)methanesulfonamide Traditional Name: N-(cyanomethyl)-1-(3-nitrophenyl)-N-(2-propoxypropyl)methanesulfonamide Formula: C15H21N3O5S MolecularWeight: 355.40934

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C)CN(CC#N)S(=O)(=O)CC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCCOC(C)CN(CC#N)S(=O)(=O)CC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O5S/c1-3-9-23-13(2)11-17(8-7-16)24(21,22)12-14-5-4-6-15(10-14)18(19)20/h4-6,10,13H,3,8-9,11-12H2,1-2H3