propan-2-yl (3S)-3-(4-methoxyphenyl)-3-[3-(1-phenylpyrazol-4-yl)propanoylamino]propanoate

Systemtic Name: propan-2-yl (3S)-3-(4-methoxyphenyl)-3-[3-(1-phenylpyrazol-4-yl)propanoylamino]propanoate Openeye Name: isopropyl (3S)-3-(4-methoxyphenyl)-3-[3-(1-phenylpyrazol-4-yl)propanoylamino]propanoate CAS Name: (3S)-3-(4-methoxyphenyl)-3-[[1-oxo-3-(1-phenyl-4-pyrazolyl)propyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3S)-3-(4-methoxyphenyl)-3-[3-(1-phenylpyrazol-4-yl)propanoylamino]propanoate Traditional Name: (3S)-3-(4-methoxyphenyl)-3-[3-(1-phenylpyrazol-4-yl)propanoylamino]propionic acid isopropyl ester Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=C(C=C1)OC)NC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C[C@@H](C1=CC=C(C=C1)OC)NC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H29N3O4/c1-18(2)32-25(30)15-23(20-10-12-22(31-3)13-11-20)27-24(29)14-9-19-16-26-28(17-19)21-7-5-4-6-8-21/h4-8,10-13,16-18,23H,9,14-15H2,1-3H3,(H,27,29)/t23-/m0/s1