2-[[[(2R)-2-(benzotriazol-1-yl)propanoyl]hydrazinylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[[(2R)-2-(benzotriazol-1-yl)propanoyl]hydrazinylidene]methyl]-4-nitro-phenolate Openeye Name: 2-[[[(2R)-2-(benzotriazol-1-yl)propanoyl]hydrazono]methyl]-4-nitro-phenolate CAS Name: 2-[[[(2R)-2-(1-benzotriazolyl)-1-oxopropyl]hydrazinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[[[(2R)-2-(benzotriazol-1-yl)propanoyl]hydrazinylidene]methyl]-4-nitrophenolate Traditional Name: 2-[[[(2R)-2-(benzotriazol-1-yl)propanoyl]hydrazono]methyl]-4-nitro-phenolate Formula: C16H13N6O4- MolecularWeight: 353.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-])N2C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@H](C(=O)NN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-])N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H14N6O4/c1-10(21-14-5-3-2-4-13(14)18-20-21)16(24)19-17-9-11-8-12(22(25)26)6-7-15(11)23/h2-10,23H,1H3,(H,19,24)/p-1/t10-/m1/s1