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

Systemtic Name: methyl 2-[[4-(3-chlorophenyl)piperazin-1-yl]carbonylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-3-methyl-pentanoate CAS Name: 2-[[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-3-methylpentanoate Traditional Name: 2-[[4-(3-chlorophenyl)piperazine-1-carbonyl]amino]-3-methyl-valeric acid methyl ester Formula: C18H26ClN3O3 MolecularWeight: 367.87034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26ClN3O3/c1-4-13(2)16(17(23)25-3)20-18(24)22-10-8-21(9-11-22)15-7-5-6-14(19)12-15/h5-7,12-13,16H,4,8-11H2,1-3H3,(H,20,24)