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

Systemtic Name: 2-(4-butoxyphenyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one Openeye Name: 2-(4-butoxyphenyl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-1-(3-pyridylmethyl)-2H-pyrrol-5-one CAS Name: 2-(4-butoxyphenyl)-4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-1-(3-pyridinylmethyl)-2H-pyrrol-5-one IUPAC Name: 2-(4-butoxyphenyl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one Traditional Name: 5-(4-butoxyphenyl)-3-hydroxy-4-[(E)-3-phenylacryloyl]-1-(3-pyridylmethyl)-3-pyrrolin-2-one Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(=C(C(=O)N2CC3=CN=CC=C3)O)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C(=C(C(=O)N2CC3=CN=CC=C3)O)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C29H28N2O4/c1-2-3-18-35-24-14-12-23(13-15-24)27-26(25(32)16-11-21-8-5-4-6-9-21)28(33)29(34)31(27)20-22-10-7-17-30-19-22/h4-17,19,27,33H,2-3,18,20H2,1H3/b16-11+