(2R)-1-[[5-(4-methylpiperazin-4-ium-1-yl)-2-nitro-phenyl]amino]propan-2-ol

Systemtic Name: (2R)-1-[[5-(4-methylpiperazin-4-ium-1-yl)-2-nitro-phenyl]amino]propan-2-ol Openeye Name: (2R)-1-[5-(4-methylpiperazin-4-ium-1-yl)-2-nitro-anilino]propan-2-ol CAS Name: (2R)-1-[5-(4-methyl-1-piperazin-4-iumyl)-2-nitroanilino]-2-propanol IUPAC Name: (2R)-1-[5-(4-methylpiperazin-4-ium-1-yl)-2-nitroanilino]propan-2-ol Traditional Name: (2R)-1-[5-(4-methylpiperazin-4-ium-1-yl)-2-nitro-anilino]propan-2-ol Formula: C14H23N4O3+ MolecularWeight: 295.35742

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C(C=CC(=C1)N2CC[NH+](CC2)C)[N+](=O)[O-])O

Isomeric SMILES

C[C@H](CNC1=C(C=CC(=C1)N2CC[NH+](CC2)C)[N+](=O)[O-])O

InChI

InChI=1S/C14H22N4O3/c1-11(19)10-15-13-9-12(3-4-14(13)18(20)21)17-7-5-16(2)6-8-17/h3-4,9,11,15,19H,5-8,10H2,1-2H3/p+1/t11-/m1/s1