(4-pyrazol-1-ylphenyl)methyl 2-benzamido-3-phenyl-propanoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 2-benzamido-3-phenyl-propanoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 2-benzamido-3-phenyl-propanoate CAS Name: 2-benzamido-3-phenylpropanoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 2-benzamido-3-phenylpropanoate Traditional Name: 2-benzamido-3-phenyl-propionic acid (4-pyrazol-1-ylbenzyl) ester Formula: C26H23N3O3 MolecularWeight: 425.47912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H23N3O3/c30-25(22-10-5-2-6-11-22)28-24(18-20-8-3-1-4-9-20)26(31)32-19-21-12-14-23(15-13-21)29-17-7-16-27-29/h1-17,24H,18-19H2,(H,28,30)