ethyl 4-[(4-fluorophenyl)methylcarbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[(4-fluorophenyl)methylcarbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(4-fluorophenyl)methylcarbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[[(4-fluorophenyl)methylamino]-oxomethyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-fluorophenyl)methylcarbamoyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-[(4-fluorobenzyl)carbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C18H21FN2O3 MolecularWeight: 332.369343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)NCC2=CC=C(C=C2)F)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)NCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C18H21FN2O3/c1-5-24-18(23)16-11(2)15(12(3)21(16)4)17(22)20-10-13-6-8-14(19)9-7-13/h6-9H,5,10H2,1-4H3,(H,20,22)