(E)-3-(2-azido-4-nitro-phenyl)-2-[(2-chloranylpyridin-3-yl)carbonylamino]prop-2-enoic acid

Systemtic Name: (E)-3-(2-azido-4-nitro-phenyl)-2-[(2-chloranylpyridin-3-yl)carbonylamino]prop-2-enoic acid Openeye Name: (E)-3-(2-azido-4-nitro-phenyl)-2-[(2-chloropyridine-3-carbonyl)amino]prop-2-enoic acid CAS Name: (E)-3-(2-azido-4-nitrophenyl)-2-[[(2-chloro-3-pyridinyl)-oxomethyl]amino]-2-propenoic acid IUPAC Name: (E)-3-(2-azido-4-nitrophenyl)-2-[(2-chloropyridine-3-carbonyl)amino]prop-2-enoic acid Traditional Name: (E)-3-(2-azido-4-nitro-phenyl)-2-[(2-chloronicotinoyl)amino]acrylic acid Formula: C15H9ClN6O5 MolecularWeight: 388.72216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)Cl)C(=O)NC(=CC2=C(C=C(C=C2)[N+](=O)[O-])N=[N+]=[N-])C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)Cl)C(=O)N/C(=C/C2=C(C=C(C=C2)[N+](=O)[O-])N=[N+]=[N-])/C(=O)O

InChI

InChI=1S/C15H9ClN6O5/c16-13-10(2-1-5-18-13)14(23)19-12(15(24)25)6-8-3-4-9(22(26)27)7-11(8)20-21-17/h1-7H,(H,19,23)(H,24,25)/b12-6+