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

Systemtic Name: methyl 2-[[4-(3-chlorophenyl)piperazin-1-yl]carbonylamino]-3-methyl-butanoate Openeye Name: methyl 2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-3-methyl-butanoate CAS Name: 2-[[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-3-methylbutanoate Traditional Name: 2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-3-methyl-butyric acid methyl ester Formula: C17H24ClN3O3 MolecularWeight: 353.84376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24ClN3O3/c1-12(2)15(16(22)24-3)19-17(23)21-9-7-20(8-10-21)14-6-4-5-13(18)11-14/h4-6,11-12,15H,7-10H2,1-3H3,(H,19,23)