2-[(4-methylpiperazin-1-yl)methyl]-4-nitro-phenol

Systemtic Name: 2-[(4-methylpiperazin-1-yl)methyl]-4-nitro-phenol Openeye Name: 2-[(4-methylpiperazin-1-yl)methyl]-4-nitro-phenol CAS Name: 2-[(4-methyl-1-piperazinyl)methyl]-4-nitrophenol IUPAC Name: 2-[(4-methylpiperazin-1-yl)methyl]-4-nitrophenol Traditional Name: 2-[(4-methylpiperazino)methyl]-4-nitro-phenol Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CN1CCN(CC1)CC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C12H17N3O3/c1-13-4-6-14(7-5-13)9-10-8-11(15(17)18)2-3-12(10)16/h2-3,8,16H,4-7,9H2,1H3