4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-(1-phenylpyrazol-4-yl)ethanoate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-(1-phenylpyrazol-4-yl)ethanoate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 2-(1-phenylpyrazol-4-yl)acetate CAS Name: 2-(1-phenyl-4-pyrazolyl)acetic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 2-(1-phenylpyrazol-4-yl)acetate Traditional Name: 2-(1-phenylpyrazol-4-yl)acetic acid 4-phthalimidobutyl ester Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CC(=O)OCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CC(=O)OCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H21N3O4/c27-21(14-17-15-24-26(16-17)18-8-2-1-3-9-18)30-13-7-6-12-25-22(28)19-10-4-5-11-20(19)23(25)29/h1-5,8-11,15-16H,6-7,12-14H2