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

Systemtic Name: 2-(3-butoxyphenyl)-1-(2-dimethylaminoethyl)-4-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Openeye Name: 2-(3-butoxyphenyl)-1-(2-dimethylaminoethyl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one CAS Name: 2-(3-butoxyphenyl)-1-(2-dimethylaminoethyl)-4-hydroxy-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-5-one IUPAC Name: 2-(3-butoxyphenyl)-1-(2-dimethylaminoethyl)-4-hydroxy-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one Traditional Name: 5-(3-butoxyphenyl)-1-(2-dimethylaminoethyl)-3-hydroxy-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CCN(C)C)O)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CCN(C)C)O)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C27H32N2O4/c1-4-5-18-33-22-13-9-12-21(19-22)25-24(23(30)15-14-20-10-7-6-8-11-20)26(31)27(32)29(25)17-16-28(2)3/h6-15,19,25,31H,4-5,16-18H2,1-3H3/b15-14+