2-(4-butoxy-3-ethoxy-phenyl)-4-oxidanyl-1-phenethyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 2-(4-butoxy-3-ethoxy-phenyl)-4-oxidanyl-1-phenethyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 2-(4-butoxy-3-ethoxy-phenyl)-4-hydroxy-1-phenethyl-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 2-(4-butoxy-3-ethoxyphenyl)-4-hydroxy-3-[oxo(thiophen-2-yl)methyl]-1-phenethyl-2H-pyrrol-5-one IUPAC Name: 2-(4-butoxy-3-ethoxyphenyl)-4-hydroxy-1-phenethyl-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 5-(4-butoxy-3-ethoxy-phenyl)-3-hydroxy-1-phenethyl-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C29H31NO5S MolecularWeight: 505.62514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCC3=CC=CC=C3)O)C(=O)C4=CC=CS4)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCC3=CC=CC=C3)O)C(=O)C4=CC=CS4)OCC

InChI

InChI=1S/C29H31NO5S/c1-3-5-17-35-22-14-13-21(19-23(22)34-4-2)26-25(27(31)24-12-9-18-36-24)28(32)29(33)30(26)16-15-20-10-7-6-8-11-20/h6-14,18-19,26,32H,3-5,15-17H2,1-2H3