ethyl 1-[(3-chlorophenyl)methyl]-4-(triphenylmethyl)piperazine-2-carboxylate

Systemtic Name: ethyl 1-[(3-chlorophenyl)methyl]-4-(triphenylmethyl)piperazine-2-carboxylate Openeye Name: ethyl 1-[(3-chlorophenyl)methyl]-4-trityl-piperazine-2-carboxylate CAS Name: 1-[(3-chlorophenyl)methyl]-4-(triphenylmethyl)-2-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3-chlorophenyl)methyl]-4-tritylpiperazine-2-carboxylate Traditional Name: 1-(3-chlorobenzyl)-4-trityl-piperazine-2-carboxylic acid ethyl ester Formula: C33H33ClN2O2 MolecularWeight: 525.08032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(CCN1CC2=CC(=CC=C2)Cl)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1CN(CCN1CC2=CC(=CC=C2)Cl)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H33ClN2O2/c1-2-38-32(37)31-25-36(22-21-35(31)24-26-13-12-20-30(34)23-26)33(27-14-6-3-7-15-27,28-16-8-4-9-17-28)29-18-10-5-11-19-29/h3-20,23,31H,2,21-22,24-25H2,1H3