2-[[1-[3,4-bis(azanyl)-1H-pyrazol-5-yl]-2-methyl-propyl]amino]-4-nitro-phenol

Systemtic Name: 2-[[1-[3,4-bis(azanyl)-1H-pyrazol-5-yl]-2-methyl-propyl]amino]-4-nitro-phenol Openeye Name: 2-[[1-(3,4-diamino-1H-pyrazol-5-yl)-2-methyl-propyl]amino]-4-nitro-phenol CAS Name: 2-[[1-(3,4-diamino-1H-pyrazol-5-yl)-2-methylpropyl]amino]-4-nitrophenol IUPAC Name: 2-[[1-(3,4-diamino-1H-pyrazol-5-yl)-2-methylpropyl]amino]-4-nitrophenol Traditional Name: 2-[[1-(3,4-diamino-1H-pyrazol-5-yl)-2-methyl-propyl]amino]-4-nitro-phenol Formula: C13H18N6O3 MolecularWeight: 306.32042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C(C(=NN1)N)N)NC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)C(C1=C(C(=NN1)N)N)NC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C13H18N6O3/c1-6(2)11(12-10(14)13(15)18-17-12)16-8-5-7(19(21)22)3-4-9(8)20/h3-6,11,16,20H,14H2,1-2H3,(H3,15,17,18)