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

Systemtic Name: 2-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one Openeye Name: 2-(3-ethoxy-4-isopentyloxy-phenyl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-1-(3-pyridylmethyl)-2H-pyrrol-5-one CAS Name: 2-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-1-(3-pyridinylmethyl)-2H-pyrrol-5-one IUPAC Name: 2-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one Traditional Name: 5-(3-ethoxy-4-isoamoxy-phenyl)-3-hydroxy-4-[(E)-3-phenylacryloyl]-1-(3-pyridylmethyl)-3-pyrrolin-2-one Formula: C32H34N2O5 MolecularWeight: 526.62276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2CC3=CN=CC=C3)O)C(=O)C=CC4=CC=CC=C4)OCCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2CC3=CN=CC=C3)O)C(=O)/C=C/C4=CC=CC=C4)OCCC(C)C

InChI

InChI=1S/C32H34N2O5/c1-4-38-28-19-25(13-15-27(28)39-18-16-22(2)3)30-29(26(35)14-12-23-9-6-5-7-10-23)31(36)32(37)34(30)21-24-11-8-17-33-20-24/h5-15,17,19-20,22,30,36H,4,16,18,21H2,1-3H3/b14-12+