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

Systemtic Name: methyl 2-[[3-chloranyl-4-(4-ethylpiperazin-1-yl)phenyl]carbamoylamino]propanoate Openeye Name: methyl 2-[[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]carbamoylamino]propanoate CAS Name: 2-[[[3-chloro-4-(4-ethyl-1-piperazinyl)anilino]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]carbamoylamino]propanoate Traditional Name: 2-[[3-chloro-4-(4-ethylpiperazino)phenyl]carbamoylamino]propionic acid methyl ester Formula: C17H25ClN4O3 MolecularWeight: 368.8584

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)NC(C)C(=O)OC)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)NC(C)C(=O)OC)Cl

InChI

InChI=1S/C17H25ClN4O3/c1-4-21-7-9-22(10-8-21)15-6-5-13(11-14(15)18)20-17(24)19-12(2)16(23)25-3/h5-6,11-12H,4,7-10H2,1-3H3,(H2,19,20,24)