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

Systemtic Name: 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]pentanoic acid Openeye Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]pentanoic acid CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]pentanoic acid IUPAC Name: 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]pentanoic acid Traditional Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]valeric acid Formula: C14H14ClNO3S MolecularWeight: 311.78386

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CCCC(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C14H14ClNO3S/c1-2-5-9(14(18)19)16-13(17)12-11(15)8-6-3-4-7-10(8)20-12/h3-4,6-7,9H,2,5H2,1H3,(H,16,17)(H,18,19)