[4-chloranyl-2-(2,5-dimethylpyrrol-1-yl)phenyl] 3,5-dimethoxybenzoate

Systemtic Name: [4-chloranyl-2-(2,5-dimethylpyrrol-1-yl)phenyl] 3,5-dimethoxybenzoate Openeye Name: [4-chloro-2-(2,5-dimethylpyrrol-1-yl)phenyl] 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid [4-chloro-2-(2,5-dimethyl-1-pyrrolyl)phenyl] ester IUPAC Name: [4-chloro-2-(2,5-dimethylpyrrol-1-yl)phenyl] 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid [4-chloro-2-(2,5-dimethylpyrrol-1-yl)phenyl] ester Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C=CC(=C2)Cl)OC(=O)C3=CC(=CC(=C3)OC)OC)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C=CC(=C2)Cl)OC(=O)C3=CC(=CC(=C3)OC)OC)C

InChI

InChI=1S/C21H20ClNO4/c1-13-5-6-14(2)23(13)19-11-16(22)7-8-20(19)27-21(24)15-9-17(25-3)12-18(10-15)26-4/h5-12H,1-4H3