2-[(2Z)-2-[1-(3-aminophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]-5-nitro-benzoic acid

Systemtic Name: 2-[(2Z)-2-[1-(3-aminophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]-5-nitro-benzoic acid Openeye Name: 2-[(2Z)-2-[1-(3-aminophenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]hydrazino]-5-nitro-benzoic acid CAS Name: 2-[(2Z)-2-[1-(3-aminophenyl)-3-methyl-5-oxo-4-pyrazolylidene]hydrazinyl]-5-nitrobenzoic acid IUPAC Name: 2-[(2Z)-2-[1-(3-aminophenyl)-3-methyl-5-oxopyrazol-4-ylidene]hydrazinyl]-5-nitrobenzoic acid Traditional Name: 2-[(N'Z)-N'-[1-(3-aminophenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]hydrazino]-5-nitro-benzoic acid Formula: C17H14N6O5 MolecularWeight: 382.33026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)C3=CC(=CC=C3)N

Isomeric SMILES

CC\1=NN(C(=O)/C1=N\NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)C3=CC(=CC=C3)N

InChI

InChI=1S/C17H14N6O5/c1-9-15(16(24)22(21-9)11-4-2-3-10(18)7-11)20-19-14-6-5-12(23(27)28)8-13(14)17(25)26/h2-8,19H,18H2,1H3,(H,25,26)/b20-15-