2-[[4-(3-chlorophenyl)piperazin-1-yl]carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[4-(3-chlorophenyl)piperazin-1-yl]carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-4-methyl-valeric acid Formula: C17H24ClN3O3 MolecularWeight: 353.84376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H24ClN3O3/c1-12(2)10-15(16(22)23)19-17(24)21-8-6-20(7-9-21)14-5-3-4-13(18)11-14/h3-5,11-12,15H,6-10H2,1-2H3,(H,19,24)(H,22,23)