N-butyl-N-(cyanomethyl)-1-(3-methoxyphenyl)methanesulfonamide

Systemtic Name: N-butyl-N-(cyanomethyl)-1-(3-methoxyphenyl)methanesulfonamide Openeye Name: N-butyl-N-(cyanomethyl)-1-(3-methoxyphenyl)methanesulfonamide CAS Name: N-butyl-N-(cyanomethyl)-1-(3-methoxyphenyl)methanesulfonamide IUPAC Name: N-butyl-N-(cyanomethyl)-1-(3-methoxyphenyl)methanesulfonamide Traditional Name: N-butyl-N-(cyanomethyl)-1-(3-methoxyphenyl)methanesulfonamide Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC#N)S(=O)(=O)CC1=CC(=CC=C1)OC

Isomeric SMILES

CCCCN(CC#N)S(=O)(=O)CC1=CC(=CC=C1)OC

InChI

InChI=1S/C14H20N2O3S/c1-3-4-9-16(10-8-15)20(17,18)12-13-6-5-7-14(11-13)19-2/h5-7,11H,3-4,9-10,12H2,1-2H3