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

Systemtic Name: 3-[3-(1-phenylpyrazol-4-yl)propanoyloxy]propyl 3-(1-phenylpyrazol-4-yl)propanoate Openeye Name: 3-[3-(1-phenylpyrazol-4-yl)propanoyloxy]propyl 3-(1-phenylpyrazol-4-yl)propanoate CAS Name: 3-(1-phenyl-4-pyrazolyl)propanoic acid 3-[1-oxo-3-(1-phenyl-4-pyrazolyl)propoxy]propyl ester IUPAC Name: 3-[3-(1-phenylpyrazol-4-yl)propanoyloxy]propyl 3-(1-phenylpyrazol-4-yl)propanoate Traditional Name: 3-(1-phenylpyrazol-4-yl)propionic acid 3-[3-(1-phenylpyrazol-4-yl)propanoyloxy]propyl ester Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N4O4/c32-26(14-12-22-18-28-30(20-22)24-8-3-1-4-9-24)34-16-7-17-35-27(33)15-13-23-19-29-31(21-23)25-10-5-2-6-11-25/h1-6,8-11,18-21H,7,12-17H2