3-methyl-4-[5-[(E)-[(3-nitropyridin-2-yl)hydrazinylidene]methyl]furan-2-yl]benzoic acid

Systemtic Name: 3-methyl-4-[5-[(E)-[(3-nitropyridin-2-yl)hydrazinylidene]methyl]furan-2-yl]benzoic acid Openeye Name: 3-methyl-4-[5-[(E)-[(3-nitro-2-pyridyl)hydrazono]methyl]-2-furyl]benzoic acid CAS Name: 3-methyl-4-[5-[(E)-[(3-nitro-2-pyridinyl)hydrazinylidene]methyl]-2-furanyl]benzoic acid IUPAC Name: 3-methyl-4-[5-[(E)-[(3-nitropyridin-2-yl)hydrazinylidene]methyl]furan-2-yl]benzoic acid Traditional Name: 3-methyl-4-[5-[(E)-[(3-nitro-2-pyridyl)hydrazono]methyl]-2-furyl]benzoic acid Formula: C18H14N4O5 MolecularWeight: 366.32756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)C2=CC=C(O2)C=NNC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)C2=CC=C(O2)/C=N/NC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O5/c1-11-9-12(18(23)24)4-6-14(11)16-7-5-13(27-16)10-20-21-17-15(22(25)26)3-2-8-19-17/h2-10H,1H3,(H,19,21)(H,23,24)/b20-10+