2-[3-imidazol-1-yl-1-(4-methoxyphenyl)-3-oxidanylidene-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-imidazol-1-yl-1-(4-methoxyphenyl)-3-oxidanylidene-propyl]isoindole-1,3-dione Openeye Name: 2-[3-imidazol-1-yl-1-(4-methoxyphenyl)-3-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[3-(1-imidazolyl)-1-(4-methoxyphenyl)-3-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-imidazol-1-yl-1-(4-methoxyphenyl)-3-oxopropyl]isoindole-1,3-dione Traditional Name: 2-[3-imidazol-1-yl-3-keto-1-(4-methoxyphenyl)propyl]isoindoline-1,3-quinone Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)N2C=CN=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=C(C=C1)C(CC(=O)N2C=CN=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H17N3O4/c1-28-15-8-6-14(7-9-15)18(12-19(25)23-11-10-22-13-23)24-20(26)16-4-2-3-5-17(16)21(24)27/h2-11,13,18H,12H2,1H3