N-[2-(cyanomethyl)-3,4-dihydro-2H-chromen-6-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-(cyanomethyl)-3,4-dihydro-2H-chromen-6-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-(cyanomethyl)chroman-6-yl]-4-methyl-benzenesulfonamide CAS Name: N-[2-(cyanomethyl)-3,4-dihydro-2H-1-benzopyran-6-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-(cyanomethyl)-3,4-dihydro-2H-chromen-6-yl]-4-methylbenzenesulfonamide Traditional Name: N-[2-(cyanomethyl)chroman-6-yl]-4-methyl-benzenesulfonamide Formula: C18H18N2O3S MolecularWeight: 342.41212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(CC3)CC#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(CC3)CC#N

InChI

InChI=1S/C18H18N2O3S/c1-13-2-7-17(8-3-13)24(21,22)20-15-5-9-18-14(12-15)4-6-16(23-18)10-11-19/h2-3,5,7-9,12,16,20H,4,6,10H2,1H3