2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3,3-dimethylbutanoic acid Traditional Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]-3,3-dimethyl-butyric acid Formula: C15H16ClNO3S MolecularWeight: 325.81044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClNO3S/c1-15(2,3)12(14(19)20)17-13(18)11-10(16)8-6-4-5-7-9(8)21-11/h4-7,12H,1-3H3,(H,17,18)(H,19,20)