1-[4-(2-methylphenyl)piperazin-1-yl]-3-(2-nitrophenoxy)propan-2-ol

Systemtic Name: 1-[4-(2-methylphenyl)piperazin-1-yl]-3-(2-nitrophenoxy)propan-2-ol Openeye Name: 1-(2-nitrophenoxy)-3-[4-(o-tolyl)piperazin-1-yl]propan-2-ol CAS Name: 1-[4-(2-methylphenyl)-1-piperazinyl]-3-(2-nitrophenoxy)-2-propanol IUPAC Name: 1-[4-(2-methylphenyl)piperazin-1-yl]-3-(2-nitrophenoxy)propan-2-ol Traditional Name: 1-(2-nitrophenoxy)-3-[4-(o-tolyl)piperazino]propan-2-ol Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=CC=C3[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=CC=C3[N+](=O)[O-])O

InChI

InChI=1S/C20H25N3O4/c1-16-6-2-3-7-18(16)22-12-10-21(11-13-22)14-17(24)15-27-20-9-5-4-8-19(20)23(25)26/h2-9,17,24H,10-15H2,1H3