1-[4-[(4-bromophenyl)-phenyl-methyl]-2-tert-butyl-piperazin-1-yl]-2-(1-ethanoylpiperidin-4-yl)ethanone

Systemtic Name: 1-[4-[(4-bromophenyl)-phenyl-methyl]-2-tert-butyl-piperazin-1-yl]-2-(1-ethanoylpiperidin-4-yl)ethanone Openeye Name: 2-(1-acetyl-4-piperidyl)-1-[4-[(4-bromophenyl)-phenyl-methyl]-2-tert-butyl-piperazin-1-yl]ethanone CAS Name: 2-(1-acetyl-4-piperidinyl)-1-[4-[(4-bromophenyl)-phenylmethyl]-2-tert-butyl-1-piperazinyl]ethanone IUPAC Name: 2-(1-acetylpiperidin-4-yl)-1-[4-[(4-bromophenyl)-phenylmethyl]-2-tert-butylpiperazin-1-yl]ethanone Traditional Name: 2-(1-acetyl-4-piperidyl)-1-[4-[(4-bromophenyl)-phenyl-methyl]-2-tert-butyl-piperazino]ethanone Formula: C30H40BrN3O2 MolecularWeight: 554.5615

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)CC(=O)N2CCN(CC2C(C)(C)C)C(C3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(=O)N1CCC(CC1)CC(=O)N2CCN(CC2C(C)(C)C)C(C3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C30H40BrN3O2/c1-22(35)32-16-14-23(15-17-32)20-28(36)34-19-18-33(21-27(34)30(2,3)4)29(24-8-6-5-7-9-24)25-10-12-26(31)13-11-25/h5-13,23,27,29H,14-21H2,1-4H3