ethyl 4-[3-chloranyl-5-(4-ethoxycarbonylpiperazin-1-yl)phenyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-chloranyl-5-(4-ethoxycarbonylpiperazin-1-yl)phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-chloro-5-(4-ethoxycarbonylpiperazin-1-yl)phenyl]piperazine-1-carboxylate CAS Name: 4-[3-chloro-5-(4-ethoxycarbonyl-1-piperazinyl)phenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-chloro-5-(4-ethoxycarbonylpiperazin-1-yl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[3-(4-carbethoxypiperazino)-5-chloro-phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H29ClN4O4 MolecularWeight: 424.92166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=CC(=CC(=C2)Cl)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=CC(=CC(=C2)Cl)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C20H29ClN4O4/c1-3-28-19(26)24-9-5-22(6-10-24)17-13-16(21)14-18(15-17)23-7-11-25(12-8-23)20(27)29-4-2/h13-15H,3-12H2,1-2H3