(4-methoxyphenyl) 3-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]piperazine-1-carboxylate

Systemtic Name: (4-methoxyphenyl) 3-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]piperazine-1-carboxylate Openeye Name: (4-methoxyphenyl) 3-[(3-chloro-4-methoxy-phenyl)methylcarbamoyl]piperazine-1-carboxylate CAS Name: 3-[[(3-chloro-4-methoxyphenyl)methylamino]-oxomethyl]-1-piperazinecarboxylic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 3-[(3-chloro-4-methoxyphenyl)methylcarbamoyl]piperazine-1-carboxylate Traditional Name: 3-[(3-chloro-4-methoxy-benzyl)carbamoyl]piperazine-1-carboxylic acid (4-methoxyphenyl) ester Formula: C21H24ClN3O5 MolecularWeight: 433.88536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC(=O)N2CCNC(C2)C(=O)NCC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

COC1=CC=C(C=C1)OC(=O)N2CCNC(C2)C(=O)NCC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H24ClN3O5/c1-28-15-4-6-16(7-5-15)30-21(27)25-10-9-23-18(13-25)20(26)24-12-14-3-8-19(29-2)17(22)11-14/h3-8,11,18,23H,9-10,12-13H2,1-2H3,(H,24,26)