2-(4-tert-butylphenoxy)-1-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-tert-butylphenoxy)-1-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]ethanone Openeye Name: 2-(4-tert-butylphenoxy)-1-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]ethanone CAS Name: 2-(4-tert-butylphenoxy)-1-[4-(1-phenyl-5-tetrazolyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-tert-butylphenoxy)-1-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]ethanone Traditional Name: 2-(4-tert-butylphenoxy)-1-[4-(1-phenyltetrazol-5-yl)piperazino]ethanone Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C23H28N6O2/c1-23(2,3)18-9-11-20(12-10-18)31-17-21(30)27-13-15-28(16-14-27)22-24-25-26-29(22)19-7-5-4-6-8-19/h4-12H,13-17H2,1-3H3