propyl 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)carbamoyl]-4-oxidanyl-benzoate

Systemtic Name: propyl 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)carbamoyl]-4-oxidanyl-benzoate Openeye Name: propyl 3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)carbamoyl]-4-hydroxy-benzoate CAS Name: 3-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-oxomethyl]-4-hydroxybenzoic acid propyl ester IUPAC Name: propyl 3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]-4-hydroxybenzoate Traditional Name: 4-hydroxy-3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)carbamoyl]benzoic acid propyl ester Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=C(C=C1)O)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCCOC(=O)C1=CC(=C(C=C1)O)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C22H23N3O5/c1-4-12-30-22(29)15-10-11-18(26)17(13-15)20(27)23-19-14(2)24(3)25(21(19)28)16-8-6-5-7-9-16/h5-11,13,26H,4,12H2,1-3H3,(H,23,27)