methyl 2-[[1-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[[1-(4-bromanyl-3-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[1-(4-bromo-3-methyl-phenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[[1-(4-bromo-3-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[1-(4-bromo-3-methylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[1-(4-bromo-3-methyl-phenyl)-5-keto-pyrrolidine-3-carbonyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C22H23BrN2O6 MolecularWeight: 491.33182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC(CC2=O)C(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC(CC2=O)C(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC)Br

InChI

InChI=1S/C22H23BrN2O6/c1-12-7-14(5-6-16(12)23)25-11-13(8-20(25)26)21(27)24-17-10-19(30-3)18(29-2)9-15(17)22(28)31-4/h5-7,9-10,13H,8,11H2,1-4H3,(H,24,27)