methyl 3-[[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]carbonylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]carbonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[1-(2-fluorophenyl)-2,5-dimethyl-pyrrole-3-carbonyl]amino]-4-methyl-benzoate CAS Name: 3-[[[1-(2-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-oxomethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[1-(2-fluorophenyl)-2,5-dimethylpyrrole-3-carbonyl]amino]-4-methylbenzoate Traditional Name: 3-[[1-(2-fluorophenyl)-2,5-dimethyl-pyrrole-3-carbonyl]amino]-4-methyl-benzoic acid methyl ester Formula: C22H21FN2O3 MolecularWeight: 380.412143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=C(N(C(=C2)C)C3=CC=CC=C3F)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=C(N(C(=C2)C)C3=CC=CC=C3F)C

InChI

InChI=1S/C22H21FN2O3/c1-13-9-10-16(22(27)28-4)12-19(13)24-21(26)17-11-14(2)25(15(17)3)20-8-6-5-7-18(20)23/h5-12H,1-4H3,(H,24,26)