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

Systemtic Name: 1-[2-tert-butyl-4-[(4-ethoxyphenyl)-phenyl-methyl]piperazin-1-yl]-2-(1-ethanoylpiperidin-4-yl)ethanone Openeye Name: 2-(1-acetyl-4-piperidyl)-1-[2-tert-butyl-4-[(4-ethoxyphenyl)-phenyl-methyl]piperazin-1-yl]ethanone CAS Name: 2-(1-acetyl-4-piperidinyl)-1-[2-tert-butyl-4-[(4-ethoxyphenyl)-phenylmethyl]-1-piperazinyl]ethanone IUPAC Name: 2-(1-acetylpiperidin-4-yl)-1-[2-tert-butyl-4-[(4-ethoxyphenyl)-phenylmethyl]piperazin-1-yl]ethanone Traditional Name: 2-(1-acetyl-4-piperidyl)-1-[2-tert-butyl-4-[phenyl(p-phenetyl)methyl]piperazino]ethanone Formula: C32H45N3O3 MolecularWeight: 519.718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCN(C(C3)C(C)(C)C)C(=O)CC4CCN(CC4)C(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCN(C(C3)C(C)(C)C)C(=O)CC4CCN(CC4)C(=O)C

InChI

InChI=1S/C32H45N3O3/c1-6-38-28-14-12-27(13-15-28)31(26-10-8-7-9-11-26)34-20-21-35(29(23-34)32(3,4)5)30(37)22-25-16-18-33(19-17-25)24(2)36/h7-15,25,29,31H,6,16-23H2,1-5H3