(2S)-1-butoxy-3-[4-(4-nitrophenyl)piperazin-1-yl]propan-2-ol

Systemtic Name: (2S)-1-butoxy-3-[4-(4-nitrophenyl)piperazin-1-yl]propan-2-ol Openeye Name: (2S)-1-butoxy-3-[4-(4-nitrophenyl)piperazin-1-yl]propan-2-ol CAS Name: (2S)-1-butoxy-3-[4-(4-nitrophenyl)-1-piperazinyl]-2-propanol IUPAC Name: (2S)-1-butoxy-3-[4-(4-nitrophenyl)piperazin-1-yl]propan-2-ol Traditional Name: (2S)-1-butoxy-3-[4-(4-nitrophenyl)piperazino]propan-2-ol Formula: C17H27N3O4 MolecularWeight: 337.41398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(CN1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCCCOC[C@H](CN1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H27N3O4/c1-2-3-12-24-14-17(21)13-18-8-10-19(11-9-18)15-4-6-16(7-5-15)20(22)23/h4-7,17,21H,2-3,8-14H2,1H3/t17-/m0/s1