2-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]pyrimidine Openeye Name: 2-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]pyrimidine CAS Name: 2-[4-[2-(3-nitrophenoxy)ethyl]-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]pyrimidine Traditional Name: 2-[4-[2-(3-nitrophenoxy)ethyl]piperazino]pyrimidine Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC(=C2)[N+](=O)[O-])C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC(=C2)[N+](=O)[O-])C3=NC=CC=N3

InChI

InChI=1S/C16H19N5O3/c22-21(23)14-3-1-4-15(13-14)24-12-11-19-7-9-20(10-8-19)16-17-5-2-6-18-16/h1-6,13H,7-12H2