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

Systemtic Name: 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-methyl-pentanoic acid Openeye Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-methyl-pentanoic acid CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-methylpentanoic acid Traditional Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-methyl-valeric acid Formula: C15H16ClNO3S MolecularWeight: 325.81044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClNO3S/c1-3-8(2)12(15(19)20)17-14(18)13-11(16)9-6-4-5-7-10(9)21-13/h4-8,12H,3H2,1-2H3,(H,17,18)(H,19,20)