N-[3-(dimethylamino)propyl]-2-methyl-prop-2-enamide; 4-methylbenzenesulfonic acid

Systemtic Name: N-[3-(dimethylamino)propyl]-2-methyl-prop-2-enamide; 4-methylbenzenesulfonic acid Openeye Name: N-[3-(dimethylamino)propyl]-2-methyl-prop-2-enamide; 4-methylbenzenesulfonic acid CAS Name: N-[3-(dimethylamino)propyl]-2-methyl-2-propenamide; 4-methylbenzenesulfonic acid IUPAC Name: N-[3-(dimethylamino)propyl]-2-methylprop-2-enamide; 4-methylbenzenesulfonic acid Traditional Name: N-[3-(dimethylamino)propyl]-2-methyl-acrylamide; tosylic acid Formula: C16H26N2O4S MolecularWeight: 342.45364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC(=C)C(=O)NCCCN(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC(=C)C(=O)NCCCN(C)C

InChI

InChI=1S/C9H18N2O.C7H8O3S/c1-8(2)9(12)10-6-5-7-11(3)4;1-6-2-4-7(5-3-6)11(8,9)10/h1,5-7H2,2-4H3,(H,10,12);2-5H,1H3,(H,8,9,10)