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

Systemtic Name: 1-[3-[(E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[3-[(E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one CAS Name: 1-[3-[(E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-1-oxoprop-2-enyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[3-[(E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[3-[(E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)acryloyl]phenyl]-2-pyrrolidone Formula: C20H18BrNO4 MolecularWeight: 416.26522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)C2=CC(=CC=C2)N3CCCC3=O)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)C2=CC(=CC=C2)N3CCCC3=O)Br)O

InChI

InChI=1S/C20H18BrNO4/c1-26-18-11-13(10-16(21)20(18)25)7-8-17(23)14-4-2-5-15(12-14)22-9-3-6-19(22)24/h2,4-5,7-8,10-12,25H,3,6,9H2,1H3/b8-7+