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

Systemtic Name: 2-(4-butoxyphenyl)-1-(3-imidazol-1-ylpropyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 2-(4-butoxyphenyl)-4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 2-(4-butoxyphenyl)-4-hydroxy-1-[3-(1-imidazolyl)propyl]-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-5-one IUPAC Name: 2-(4-butoxyphenyl)-4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 5-(4-butoxyphenyl)-3-hydroxy-1-(3-imidazol-1-ylpropyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C29H31N3O4 MolecularWeight: 485.57414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C29H31N3O4/c1-2-3-20-36-24-13-11-23(12-14-24)27-26(25(33)15-10-22-8-5-4-6-9-22)28(34)29(35)32(27)18-7-17-31-19-16-30-21-31/h4-6,8-16,19,21,27,34H,2-3,7,17-18,20H2,1H3/b15-10+