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

Systemtic Name: 2-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]phenol Openeye Name: 2-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]phenol CAS Name: 2-[4-[2-(3-nitrophenoxy)ethyl]-1-piperazinyl]phenol IUPAC Name: 2-[4-[2-(3-nitrophenoxy)ethyl]piperazin-1-yl]phenol Traditional Name: 2-[4-[2-(3-nitrophenoxy)ethyl]piperazino]phenol Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3O

Isomeric SMILES

C1CN(CCN1CCOC2=CC=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3O

InChI

InChI=1S/C18H21N3O4/c22-18-7-2-1-6-17(18)20-10-8-19(9-11-20)12-13-25-16-5-3-4-15(14-16)21(23)24/h1-7,14,22H,8-13H2