(4-benzamidophenyl) 3-(1-phenylpyrazol-4-yl)propanoate

Systemtic Name: (4-benzamidophenyl) 3-(1-phenylpyrazol-4-yl)propanoate Openeye Name: (4-benzamidophenyl) 3-(1-phenylpyrazol-4-yl)propanoate CAS Name: 3-(1-phenyl-4-pyrazolyl)propanoic acid (4-benzamidophenyl) ester IUPAC Name: (4-benzamidophenyl) 3-(1-phenylpyrazol-4-yl)propanoate Traditional Name: 3-(1-phenylpyrazol-4-yl)propionic acid (4-benzamidophenyl) ester Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)OC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)OC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O3/c29-24(16-11-19-17-26-28(18-19)22-9-5-2-6-10-22)31-23-14-12-21(13-15-23)27-25(30)20-7-3-1-4-8-20/h1-10,12-15,17-18H,11,16H2,(H,27,30)