ethyl 3-nitro-5-[(2-pyrazol-1-ylpyridin-3-yl)carbamoyl]benzoate

Systemtic Name: ethyl 3-nitro-5-[(2-pyrazol-1-ylpyridin-3-yl)carbamoyl]benzoate Openeye Name: ethyl 3-nitro-5-[(2-pyrazol-1-yl-3-pyridyl)carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[[2-(1-pyrazolyl)-3-pyridinyl]amino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-[(2-pyrazol-1-ylpyridin-3-yl)carbamoyl]benzoate Traditional Name: 3-nitro-5-[(2-pyrazol-1-yl-3-pyridyl)carbamoyl]benzoic acid ethyl ester Formula: C18H15N5O5 MolecularWeight: 381.3422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(N=CC=C2)N3C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(N=CC=C2)N3C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N5O5/c1-2-28-18(25)13-9-12(10-14(11-13)23(26)27)17(24)21-15-5-3-6-19-16(15)22-8-4-7-20-22/h3-11H,2H2,1H3,(H,21,24)