1-[4-[(E)-3-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[(E)-3-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[(E)-3-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[(E)-3-(4,5-dimethoxy-2-nitrophenyl)-1-oxoprop-2-enyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[(E)-3-(4,5-dimethoxy-2-nitrophenyl)prop-2-enoyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[(E)-3-(4,5-dimethoxy-2-nitro-phenyl)acryloyl]phenyl]-2-pyrrolidone Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=CC(=O)C2=CC=C(C=C2)N3CCCC3=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C/C(=O)C2=CC=C(C=C2)N3CCCC3=O)[N+](=O)[O-])OC

InChI

InChI=1S/C21H20N2O6/c1-28-19-12-15(17(23(26)27)13-20(19)29-2)7-10-18(24)14-5-8-16(9-6-14)22-11-3-4-21(22)25/h5-10,12-13H,3-4,11H2,1-2H3/b10-7+