(4,5-dimethoxy-2-methyl-phenyl)methyl 4-chloranyl-3-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 4-chloranyl-3-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl 4-chloro-3-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 4-chloro-3-(2-oxo-1-pyrrolidinyl)benzoic acid (4,5-dimethoxy-2-methylphenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl 4-chloro-3-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 4-chloro-3-(2-ketopyrrolidino)benzoic acid (4,5-dimethoxy-2-methyl-benzyl) ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1COC(=O)C2=CC(=C(C=C2)Cl)N3CCCC3=O)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1COC(=O)C2=CC(=C(C=C2)Cl)N3CCCC3=O)OC)OC

InChI

InChI=1S/C21H22ClNO5/c1-13-9-18(26-2)19(27-3)11-15(13)12-28-21(25)14-6-7-16(22)17(10-14)23-8-4-5-20(23)24/h6-7,9-11H,4-5,8,12H2,1-3H3