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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C(C=CC(=C1N)O)[N+](=O)[O-])C2=C(C(=NN2)N)N

Isomeric SMILES

CC(C)C(C1=C(C=CC(=C1N)O)[N+](=O)[O-])C2=C(C(=NN2)N)N

InChI

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