tert-butyl 4-[3-[3-methoxy-4-(4-methoxycarbonylphenyl)phenyl]propyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[3-methoxy-4-(4-methoxycarbonylphenyl)phenyl]propyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[3-methoxy-4-(4-methoxycarbonylphenyl)phenyl]propyl]piperazine-1-carboxylate CAS Name: 4-[3-[3-methoxy-4-(4-methoxycarbonylphenyl)phenyl]propyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[3-methoxy-4-(4-methoxycarbonylphenyl)phenyl]propyl]piperazine-1-carboxylate Traditional Name: 4-[3-[4-(4-carbomethoxyphenyl)-3-methoxy-phenyl]propyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C27H36N2O5 MolecularWeight: 468.58514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CCCC2=CC(=C(C=C2)C3=CC=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CCCC2=CC(=C(C=C2)C3=CC=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C27H36N2O5/c1-27(2,3)34-26(31)29-17-15-28(16-18-29)14-6-7-20-8-13-23(24(19-20)32-4)21-9-11-22(12-10-21)25(30)33-5/h8-13,19H,6-7,14-18H2,1-5H3