(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 1-benzylpyrazole-4-carboxylate CAS Name: 1-(phenylmethyl)-4-pyrazolecarboxylic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 1-benzylpyrazole-4-carboxylate Traditional Name: 1-benzylpyrazole-4-carboxylic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H19N3O5/c1-15(27)25-19-7-8-20-17(9-22(28)31-21(20)10-19)14-30-23(29)18-11-24-26(13-18)12-16-5-3-2-4-6-16/h2-11,13H,12,14H2,1H3,(H,25,27)