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

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 4-hydroxy-1-(3-imidazol-1-ylpropyl)-2-(3-isopentyloxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 4-hydroxy-1-[3-(1-imidazolyl)propyl]-2-[3-(3-methylbutoxy)phenyl]-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-5-one IUPAC Name: 4-hydroxy-1-(3-imidazol-1-ylpropyl)-2-[3-(3-methylbutoxy)phenyl]-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 3-hydroxy-1-(3-imidazol-1-ylpropyl)-5-(3-isoamoxyphenyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C30H33N3O4 MolecularWeight: 499.60072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H33N3O4/c1-22(2)14-19-37-25-11-6-10-24(20-25)28-27(26(34)13-12-23-8-4-3-5-9-23)29(35)30(36)33(28)17-7-16-32-18-15-31-21-32/h3-6,8-13,15,18,20-22,28,35H,7,14,16-17,19H2,1-2H3/b13-12+