methyl 2-(4-bromophenyl)-5-[4-(diphenylmethyl)piperazin-1-yl]-2-propan-2-yl-pentanoate

Systemtic Name: methyl 2-(4-bromophenyl)-5-[4-(diphenylmethyl)piperazin-1-yl]-2-propan-2-yl-pentanoate Openeye Name: methyl 5-(4-benzhydrylpiperazin-1-yl)-2-(4-bromophenyl)-2-isopropyl-pentanoate CAS Name: 2-(4-bromophenyl)-5-[4-(diphenylmethyl)-1-piperazinyl]-2-propan-2-ylpentanoic acid methyl ester IUPAC Name: methyl 5-(4-benzhydrylpiperazin-1-yl)-2-(4-bromophenyl)-2-propan-2-ylpentanoate Traditional Name: 5-(4-benzhydrylpiperazino)-2-(4-bromophenyl)-2-isopropyl-valeric acid methyl ester Formula: C32H39BrN2O2 MolecularWeight: 563.56826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=C(C=C4)Br)C(=O)OC

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CC=C(C=C4)Br)C(=O)OC

InChI

InChI=1S/C32H39BrN2O2/c1-25(2)32(31(36)37-3,28-15-17-29(33)18-16-28)19-10-20-34-21-23-35(24-22-34)30(26-11-6-4-7-12-26)27-13-8-5-9-14-27/h4-9,11-18,25,30H,10,19-24H2,1-3H3