4-[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]carbonyl-N,N-diethyl-piperazine-1-carboxamide

Systemtic Name: 4-[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]carbonyl-N,N-diethyl-piperazine-1-carboxamide Openeye Name: 4-(3-chloro-4-isobutoxy-5-methoxy-benzoyl)-N,N-diethyl-piperazine-1-carboxamide CAS Name: 4-[[3-chloro-5-methoxy-4-(2-methylpropoxy)phenyl]-oxomethyl]-N,N-diethyl-1-piperazinecarboxamide IUPAC Name: 4-[3-chloro-5-methoxy-4-(2-methylpropoxy)benzoyl]-N,N-diethylpiperazine-1-carboxamide Traditional Name: 4-(3-chloro-4-isobutoxy-5-methoxy-benzoyl)-N,N-diethyl-piperazine-1-carboxamide Formula: C21H32ClN3O4 MolecularWeight: 425.94948

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)C(=O)C2=CC(=C(C(=C2)Cl)OCC(C)C)OC

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)C(=O)C2=CC(=C(C(=C2)Cl)OCC(C)C)OC

InChI

InChI=1S/C21H32ClN3O4/c1-6-23(7-2)21(27)25-10-8-24(9-11-25)20(26)16-12-17(22)19(18(13-16)28-5)29-14-15(3)4/h12-13,15H,6-11,14H2,1-5H3