ethyl 4-[3-(3-chlorophenyl)-1-(5-methoxycarbonylfuran-2-yl)prop-2-ynyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(3-chlorophenyl)-1-(5-methoxycarbonylfuran-2-yl)prop-2-ynyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(3-chlorophenyl)-1-(5-methoxycarbonyl-2-furyl)prop-2-ynyl]piperazine-1-carboxylate CAS Name: 4-[3-(3-chlorophenyl)-1-(5-methoxycarbonyl-2-furanyl)prop-2-ynyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(3-chlorophenyl)-1-(5-methoxycarbonylfuran-2-yl)prop-2-ynyl]piperazine-1-carboxylate Traditional Name: 4-[1-(5-carbomethoxy-2-furyl)-3-(3-chlorophenyl)prop-2-ynyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H23ClN2O5 MolecularWeight: 430.88142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C#CC2=CC(=CC=C2)Cl)C3=CC=C(O3)C(=O)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(C#CC2=CC(=CC=C2)Cl)C3=CC=C(O3)C(=O)OC

InChI

InChI=1S/C22H23ClN2O5/c1-3-29-22(27)25-13-11-24(12-14-25)18(8-7-16-5-4-6-17(23)15-16)19-9-10-20(30-19)21(26)28-2/h4-6,9-10,15,18H,3,11-14H2,1-2H3