methyl 5-[[3,4-bis(fluoranyl)phenyl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[[3,4-bis(fluoranyl)phenyl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[(3,4-difluorophenyl)carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(3,4-difluoroanilino)-oxomethyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[(3,4-difluorophenyl)carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(3,4-difluorophenyl)carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C16H16F2N2O3 MolecularWeight: 322.306646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2=CC(=C(C=C2)F)F)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2=CC(=C(C=C2)F)F)C)C(=O)OC

InChI

InChI=1S/C16H16F2N2O3/c1-4-12-13(16(22)23-3)8(2)14(20-12)15(21)19-9-5-6-10(17)11(18)7-9/h5-7,20H,4H2,1-3H3,(H,19,21)