2-[4-(3-methoxy-4-nitro-phenyl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(3-methoxy-4-nitro-phenyl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(3-methoxy-4-nitro-phenyl)piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(3-methoxy-4-nitrophenyl)-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(3-methoxy-4-nitrophenyl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(3-methoxy-4-nitro-phenyl)piperazin-1-ium-1-yl]ethanol Formula: C13H20N3O4+ MolecularWeight: 282.3156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2CC[NH+](CC2)CCO)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)N2CC[NH+](CC2)CCO)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O4/c1-20-13-10-11(2-3-12(13)16(18)19)15-6-4-14(5-7-15)8-9-17/h2-3,10,17H,4-9H2,1H3/p+1