tert-butyl 4-[bis(4-chlorophenyl)methyl]-2-butyl-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[bis(4-chlorophenyl)methyl]-2-butyl-piperazine-1-carboxylate Openeye Name: tert-butyl 4-[bis(4-chlorophenyl)methyl]-2-butyl-piperazine-1-carboxylate CAS Name: 4-[bis(4-chlorophenyl)methyl]-2-butyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[bis(4-chlorophenyl)methyl]-2-butylpiperazine-1-carboxylate Traditional Name: 4-[bis(4-chlorophenyl)methyl]-2-butyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C26H34Cl2N2O2 MolecularWeight: 477.46636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1C(=O)OC(C)(C)C)C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCC1CN(CCN1C(=O)OC(C)(C)C)C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H34Cl2N2O2/c1-5-6-7-23-18-29(16-17-30(23)25(31)32-26(2,3)4)24(19-8-12-21(27)13-9-19)20-10-14-22(28)15-11-20/h8-15,23-24H,5-7,16-18H2,1-4H3