2-[4-(4-bromanyl-2-nitro-phenyl)piperazin-1-yl]phenol

Systemtic Name: 2-[4-(4-bromanyl-2-nitro-phenyl)piperazin-1-yl]phenol Openeye Name: 2-[4-(4-bromo-2-nitro-phenyl)piperazin-1-yl]phenol CAS Name: 2-[4-(4-bromo-2-nitrophenyl)-1-piperazinyl]phenol IUPAC Name: 2-[4-(4-bromo-2-nitrophenyl)piperazin-1-yl]phenol Traditional Name: 2-[4-(4-bromo-2-nitro-phenyl)piperazino]phenol Formula: C16H16BrN3O3 MolecularWeight: 378.22054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Br)[N+](=O)[O-])C3=CC=CC=C3O

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Br)[N+](=O)[O-])C3=CC=CC=C3O

InChI

InChI=1S/C16H16BrN3O3/c17-12-5-6-13(15(11-12)20(22)23)18-7-9-19(10-8-18)14-3-1-2-4-16(14)21/h1-6,11,21H,7-10H2