propan-2-yl 3-(2-chlorophenyl)-3-[[4-(2-methylpropanoyl)piperazin-1-yl]carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-(2-chlorophenyl)-3-[[4-(2-methylpropanoyl)piperazin-1-yl]carbonylamino]propanoate Openeye Name: isopropyl 3-(2-chlorophenyl)-3-[[4-(2-methylpropanoyl)piperazine-1-carbonyl]amino]propanoate CAS Name: 3-(2-chlorophenyl)-3-[[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-chlorophenyl)-3-[[4-(2-methylpropanoyl)piperazine-1-carbonyl]amino]propanoate Traditional Name: 3-(2-chlorophenyl)-3-[(4-isobutyrylpiperazine-1-carbonyl)amino]propionic acid isopropyl ester Formula: C21H30ClN3O4 MolecularWeight: 423.9336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2Cl

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2Cl

InChI

InChI=1S/C21H30ClN3O4/c1-14(2)20(27)24-9-11-25(12-10-24)21(28)23-18(13-19(26)29-15(3)4)16-7-5-6-8-17(16)22/h5-8,14-15,18H,9-13H2,1-4H3,(H,23,28)