3-[[methyl(propan-2-yl)amino]methyl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[[methyl(propan-2-yl)amino]methyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[[isopropyl(methyl)amino]methyl]benzothiophene-2-carboxylic acid CAS Name: 3-[[methyl(propan-2-yl)amino]methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[[methyl(propan-2-yl)amino]methyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[[isopropyl(methyl)amino]methyl]benzothiophene-2-carboxylic acid Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)CC1=C(SC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CC(C)N(C)CC1=C(SC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C14H17NO2S/c1-9(2)15(3)8-11-10-6-4-5-7-12(10)18-13(11)14(16)17/h4-7,9H,8H2,1-3H3,(H,16,17)