2-butyl-1-benzofuran-5-amine; 4-methylbenzenesulfonic acid

Systemtic Name: 2-butyl-1-benzofuran-5-amine; 4-methylbenzenesulfonic acid Openeye Name: 2-butylbenzofuran-5-amine; 4-methylbenzenesulfonic acid CAS Name: 2-butyl-5-benzofuranamine; 4-methylbenzenesulfonic acid IUPAC Name: 2-butyl-1-benzofuran-5-amine; 4-methylbenzenesulfonic acid Traditional Name: (2-butylbenzofuran-5-yl)amine; tosylic acid Formula: C19H23NO4S MolecularWeight: 361.45522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(O1)C=CC(=C2)N.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCC1=CC2=C(O1)C=CC(=C2)N.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C12H15NO.C7H8O3S/c1-2-3-4-11-8-9-7-10(13)5-6-12(9)14-11;1-6-2-4-7(5-3-6)11(8,9)10/h5-8H,2-4,13H2,1H3;2-5H,1H3,(H,8,9,10)