1-[4-[(E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[(E)-3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[(E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[(E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-1-oxoprop-2-enyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[(E)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[(E)-3-(3-bromo-5-ethoxy-4-methoxy-phenyl)acryloyl]phenyl]-2-pyrrolidone Formula: C22H22BrNO4 MolecularWeight: 444.31838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)C2=CC=C(C=C2)N3CCCC3=O)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)N3CCCC3=O)Br)OC

InChI

InChI=1S/C22H22BrNO4/c1-3-28-20-14-15(13-18(23)22(20)27-2)6-11-19(25)16-7-9-17(10-8-16)24-12-4-5-21(24)26/h6-11,13-14H,3-5,12H2,1-2H3/b11-6+