2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[(3-chlorobenzothiophene-2-carbonyl)amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[(3-chlorobenzothiophene-2-carbonyl)amino]acetyl]amino]acetic acid Formula: C13H11ClN2O4S MolecularWeight: 326.75544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCC(=O)NCC(=O)O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NCC(=O)NCC(=O)O)Cl

InChI

InChI=1S/C13H11ClN2O4S/c14-11-7-3-1-2-4-8(7)21-12(11)13(20)16-5-9(17)15-6-10(18)19/h1-4H,5-6H2,(H,15,17)(H,16,20)(H,18,19)