2-(4-butoxy-3-methoxy-phenyl)-1-[3-(dimethylamino)propyl]-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one

Systemtic Name: 2-(4-butoxy-3-methoxy-phenyl)-1-[3-(dimethylamino)propyl]-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 2-(4-butoxy-3-methoxy-phenyl)-1-[3-(dimethylamino)propyl]-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 2-(4-butoxy-3-methoxyphenyl)-1-[3-(dimethylamino)propyl]-4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-5-one IUPAC Name: 2-(4-butoxy-3-methoxyphenyl)-1-[3-(dimethylamino)propyl]-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 5-(4-butoxy-3-methoxy-phenyl)-1-[3-(dimethylamino)propyl]-3-hydroxy-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C29H36N2O5 MolecularWeight: 492.60654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCCN(C)C)O)C(=O)C=CC3=CC=CC=C3)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCCN(C)C)O)C(=O)/C=C/C3=CC=CC=C3)OC

InChI

InChI=1S/C29H36N2O5/c1-5-6-19-36-24-16-14-22(20-25(24)35-4)27-26(23(32)15-13-21-11-8-7-9-12-21)28(33)29(34)31(27)18-10-17-30(2)3/h7-9,11-16,20,27,33H,5-6,10,17-19H2,1-4H3/b15-13+