2-azanyl-5-heptyl-4-methyl-thiophene-3-carboxylic acid

Systemtic Name: 2-azanyl-5-heptyl-4-methyl-thiophene-3-carboxylic acid Openeye Name: 2-amino-5-heptyl-4-methyl-thiophene-3-carboxylic acid CAS Name: 2-amino-5-heptyl-4-methyl-3-thiophenecarboxylic acid IUPAC Name: 2-amino-5-heptyl-4-methylthiophene-3-carboxylic acid Traditional Name: 2-amino-5-heptyl-4-methyl-3-thenoic acid Formula: C13H21NO2S MolecularWeight: 255.37634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C(=C(S1)N)C(=O)O)C

Isomeric SMILES

CCCCCCCC1=C(C(=C(S1)N)C(=O)O)C

InChI

InChI=1S/C13H21NO2S/c1-3-4-5-6-7-8-10-9(2)11(13(15)16)12(14)17-10/h3-8,14H2,1-2H3,(H,15,16)