1-[4-[5-[[tert-butyl-(phenylmethyl)amino]methyl]furan-2-yl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[5-[[tert-butyl-(phenylmethyl)amino]methyl]furan-2-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[5-[[benzyl(tert-butyl)amino]methyl]furan-2-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[5-[[tert-butyl-(phenylmethyl)amino]methyl]-2-furanyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[5-[[benzyl(tert-butyl)amino]methyl]furan-2-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[5-[[benzyl(tert-butyl)amino]methyl]-2-furoyl]piperazino]ethanone Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=CC=C(O2)CN(CC3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=CC=C(O2)CN(CC3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C23H31N3O3/c1-18(27)24-12-14-25(15-13-24)22(28)21-11-10-20(29-21)17-26(23(2,3)4)16-19-8-6-5-7-9-19/h5-11H,12-17H2,1-4H3