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

Systemtic Name: 3-[[methyl-[2-(methylamino)-2-oxidanylidene-ethyl]amino]methyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[[methyl-[2-(methylamino)-2-oxo-ethyl]amino]methyl]benzothiophene-2-carboxylic acid CAS Name: 3-[[methyl-[2-(methylamino)-2-oxoethyl]amino]methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[[methyl-[2-(methylamino)-2-oxoethyl]amino]methyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[[[2-keto-2-(methylamino)ethyl]-methyl-amino]methyl]benzothiophene-2-carboxylic acid Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN(C)CC1=C(SC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CNC(=O)CN(C)CC1=C(SC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C14H16N2O3S/c1-15-12(17)8-16(2)7-10-9-5-3-4-6-11(9)20-13(10)14(18)19/h3-6H,7-8H2,1-2H3,(H,15,17)(H,18,19)