(Z)-3-[4-(4-nitrophenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]prop-2-enoic acid

Systemtic Name: (Z)-3-[4-(4-nitrophenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]prop-2-enoic acid Openeye Name: (Z)-3-[4-(4-nitrophenyl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]prop-2-enoic acid CAS Name: (Z)-3-[4-(4-nitrophenyl)-5-(2-pyridinyl)-1,2,4-triazol-3-yl]-2-propenoic acid IUPAC Name: (Z)-3-[4-(4-nitrophenyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]prop-2-enoic acid Traditional Name: (Z)-3-[4-(4-nitrophenyl)-5-(2-pyridyl)-1,2,4-triazol-3-yl]acrylic acid Formula: C16H11N5O4 MolecularWeight: 337.28964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NN=C(N2C3=CC=C(C=C3)[N+](=O)[O-])C=CC(=O)O

Isomeric SMILES

C1=CC=NC(=C1)C2=NN=C(N2C3=CC=C(C=C3)[N+](=O)[O-])/C=C\C(=O)O

InChI

InChI=1S/C16H11N5O4/c22-15(23)9-8-14-18-19-16(13-3-1-2-10-17-13)20(14)11-4-6-12(7-5-11)21(24)25/h1-10H,(H,22,23)/b9-8-