N-methylaniline; 4-methylbenzenesulfinic acid

Systemtic Name: N-methylaniline; 4-methylbenzenesulfinic acid Openeye Name: N-methylaniline; 4-methylbenzenesulfinic acid CAS Name: N-methylaniline; 4-methylbenzenesulfinic acid IUPAC Name: N-methylaniline; 4-methylbenzenesulfinic acid Traditional Name: 4-methylbenzenesulfinic acid; methyl(phenyl)amine Formula: C14H17NO2S MolecularWeight: 263.35528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)O.CNC1=CC=CC=C1

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)O.CNC1=CC=CC=C1

InChI

InChI=1S/C7H9N.C7H8O2S/c1-8-7-5-3-2-4-6-7;1-6-2-4-7(5-3-6)10(8)9/h2-6,8H,1H3;2-5H,1H3,(H,8,9)