[2-oxidanylidene-3-[3-(1-phenylpyrazol-4-yl)propanoyloxy]propyl] 3-(1-phenylpyrazol-4-yl)propanoate

Systemtic Name: [2-oxidanylidene-3-[3-(1-phenylpyrazol-4-yl)propanoyloxy]propyl] 3-(1-phenylpyrazol-4-yl)propanoate Openeye Name: [2-oxo-3-[3-(1-phenylpyrazol-4-yl)propanoyloxy]propyl] 3-(1-phenylpyrazol-4-yl)propanoate CAS Name: 3-(1-phenyl-4-pyrazolyl)propanoic acid [2-oxo-3-[1-oxo-3-(1-phenyl-4-pyrazolyl)propoxy]propyl] ester IUPAC Name: [2-oxo-3-[3-(1-phenylpyrazol-4-yl)propanoyloxy]propyl] 3-(1-phenylpyrazol-4-yl)propanoate Traditional Name: 3-(1-phenylpyrazol-4-yl)propionic acid [2-keto-3-[3-(1-phenylpyrazol-4-yl)propanoyloxy]propyl] ester Formula: C27H26N4O5 MolecularWeight: 486.51914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CCC(=O)OCC(=O)COC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CCC(=O)OCC(=O)COC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O5/c32-25(19-35-26(33)13-11-21-15-28-30(17-21)23-7-3-1-4-8-23)20-36-27(34)14-12-22-16-29-31(18-22)24-9-5-2-6-10-24/h1-10,15-18H,11-14,19-20H2