1-(4-tert-butylphenoxy)-3-[4-(2-nitrophenyl)piperazin-1-yl]propan-2-ol

Systemtic Name: 1-(4-tert-butylphenoxy)-3-[4-(2-nitrophenyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-(4-tert-butylphenoxy)-3-[4-(2-nitrophenyl)piperazin-1-yl]propan-2-ol CAS Name: 1-(4-tert-butylphenoxy)-3-[4-(2-nitrophenyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-(4-tert-butylphenoxy)-3-[4-(2-nitrophenyl)piperazin-1-yl]propan-2-ol Traditional Name: 1-(4-tert-butylphenoxy)-3-[4-(2-nitrophenyl)piperazino]propan-2-ol Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])O

InChI

InChI=1S/C23H31N3O4/c1-23(2,3)18-8-10-20(11-9-18)30-17-19(27)16-24-12-14-25(15-13-24)21-6-4-5-7-22(21)26(28)29/h4-11,19,27H,12-17H2,1-3H3