methyl 3-[(1-phenylpyrazol-4-yl)methylcarbamoyl]benzoate

Systemtic Name: methyl 3-[(1-phenylpyrazol-4-yl)methylcarbamoyl]benzoate Openeye Name: methyl 3-[(1-phenylpyrazol-4-yl)methylcarbamoyl]benzoate CAS Name: 3-[oxo-[(1-phenyl-4-pyrazolyl)methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(1-phenylpyrazol-4-yl)methylcarbamoyl]benzoate Traditional Name: 3-[(1-phenylpyrazol-4-yl)methylcarbamoyl]benzoic acid methyl ester Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O3/c1-25-19(24)16-7-5-6-15(10-16)18(23)20-11-14-12-21-22(13-14)17-8-3-2-4-9-17/h2-10,12-13H,11H2,1H3,(H,20,23)