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

Systemtic Name: 2-(4-tert-butylphenyl)-1-(3-imidazol-1-ylpropyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 2-(4-tert-butylphenyl)-4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 2-(4-tert-butylphenyl)-4-hydroxy-1-[3-(1-imidazolyl)propyl]-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-5-one IUPAC Name: 2-(4-tert-butylphenyl)-4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 5-(4-tert-butylphenyl)-3-hydroxy-1-(3-imidazol-1-ylpropyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H31N3O3/c1-29(2,3)23-13-11-22(12-14-23)26-25(24(33)15-10-21-8-5-4-6-9-21)27(34)28(35)32(26)18-7-17-31-19-16-30-20-31/h4-6,8-16,19-20,26,34H,7,17-18H2,1-3H3/b15-10+