2-[(4-methoxy-1-phenyl-pyrazol-3-yl)carbonylamino]terephthalic acid

Systemtic Name: 2-[(4-methoxy-1-phenyl-pyrazol-3-yl)carbonylamino]terephthalic acid Openeye Name: 2-[(4-methoxy-1-phenyl-pyrazole-3-carbonyl)amino]terephthalic acid CAS Name: 2-[[(4-methoxy-1-phenyl-3-pyrazolyl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(4-methoxy-1-phenylpyrazole-3-carbonyl)amino]terephthalic acid Traditional Name: 2-[(4-methoxy-1-phenyl-pyrazole-3-carbonyl)amino]terephthalic acid Formula: C19H15N3O6 MolecularWeight: 381.3389

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

COC1=CN(N=C1C(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C19H15N3O6/c1-28-15-10-22(12-5-3-2-4-6-12)21-16(15)17(23)20-14-9-11(18(24)25)7-8-13(14)19(26)27/h2-10H,1H3,(H,20,23)(H,24,25)(H,26,27)