2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-methylpentanoic acid Traditional Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]-4-methyl-valeric acid Formula: C15H16ClNO3S MolecularWeight: 325.81044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClNO3S/c1-8(2)7-10(15(19)20)17-14(18)13-12(16)9-5-3-4-6-11(9)21-13/h3-6,8,10H,7H2,1-2H3,(H,17,18)(H,19,20)