(1-phenylpyrazol-4-yl)methyl (3R)-3-[(2-chlorophenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: (1-phenylpyrazol-4-yl)methyl (3R)-3-[(2-chlorophenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: (1-phenylpyrazol-4-yl)methyl (3R)-3-[(2-chlorobenzoyl)amino]-3-phenyl-propanoate CAS Name: (3R)-3-[[(2-chlorophenyl)-oxomethyl]amino]-3-phenylpropanoic acid (1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (1-phenylpyrazol-4-yl)methyl (3R)-3-[(2-chlorobenzoyl)amino]-3-phenylpropanoate Traditional Name: (3R)-3-[(2-chlorobenzoyl)amino]-3-phenyl-propionic acid (1-phenylpyrazol-4-yl)methyl ester Formula: C26H22ClN3O3 MolecularWeight: 459.92418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)OCC2=CN(N=C2)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](CC(=O)OCC2=CN(N=C2)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H22ClN3O3/c27-23-14-8-7-13-22(23)26(32)29-24(20-9-3-1-4-10-20)15-25(31)33-18-19-16-28-30(17-19)21-11-5-2-6-12-21/h1-14,16-17,24H,15,18H2,(H,29,32)/t24-/m1/s1