1-(3-imidazol-1-ylpropyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2-(3-prop-2-enoxyphenyl)-2H-pyrrol-5-one

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2-(3-prop-2-enoxyphenyl)-2H-pyrrol-5-one Openeye Name: 2-(3-allyloxyphenyl)-4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 4-hydroxy-1-[3-(1-imidazolyl)propyl]-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2-(3-prop-2-enoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-2-(3-prop-2-enoxyphenyl)-2H-pyrrol-5-one Traditional Name: 5-(3-allyloxyphenyl)-3-hydroxy-1-(3-imidazol-1-ylpropyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C28H27N3O4 MolecularWeight: 469.53168

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C=CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C28H27N3O4/c1-2-18-35-23-11-6-10-22(19-23)26-25(24(32)13-12-21-8-4-3-5-9-21)27(33)28(34)31(26)16-7-15-30-17-14-29-20-30/h2-6,8-14,17,19-20,26,33H,1,7,15-16,18H2/b13-12+