3-[[cyclopropyl(ethyl)amino]methyl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[[cyclopropyl(ethyl)amino]methyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[[cyclopropyl(ethyl)amino]methyl]benzothiophene-2-carboxylic acid CAS Name: 3-[[cyclopropyl(ethyl)amino]methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[[cyclopropyl(ethyl)amino]methyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[[cyclopropyl(ethyl)amino]methyl]benzothiophene-2-carboxylic acid Formula: C15H17NO2S MolecularWeight: 275.36598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(SC2=CC=CC=C21)C(=O)O)C3CC3

Isomeric SMILES

CCN(CC1=C(SC2=CC=CC=C21)C(=O)O)C3CC3

InChI

InChI=1S/C15H17NO2S/c1-2-16(10-7-8-10)9-12-11-5-3-4-6-13(11)19-14(12)15(17)18/h3-6,10H,2,7-9H2,1H3,(H,17,18)