methyl 2-[[3-chloranyl-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]carbamoylamino]propanoate

Systemtic Name: methyl 2-[[3-chloranyl-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]carbamoylamino]propanoate Openeye Name: methyl 2-[[3-chloro-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]carbamoylamino]propanoate CAS Name: 2-[[[3-chloro-4-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]anilino]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[3-chloro-4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]carbamoylamino]propanoate Traditional Name: 2-[[3-chloro-4-(4-isobutyrylpiperazino)phenyl]carbamoylamino]propionic acid methyl ester Formula: C19H27ClN4O4 MolecularWeight: 410.89508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27ClN4O4/c1-12(2)17(25)24-9-7-23(8-10-24)16-6-5-14(11-15(16)20)22-19(27)21-13(3)18(26)28-4/h5-6,11-13H,7-10H2,1-4H3,(H2,21,22,27)