ethyl 4-[[(2-fluorophenyl)carbonyl-(furan-2-ylmethyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[[(2-fluorophenyl)carbonyl-(furan-2-ylmethyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[[(2-fluorobenzoyl)-(2-furylmethyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[[[(2-fluorophenyl)-oxomethyl]-(2-furanylmethyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(2-fluorobenzoyl)-(furan-2-ylmethyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[[(2-fluorobenzoyl)-(2-furfuryl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C22H23FN2O4 MolecularWeight: 398.427423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)CN(CC2=CC=CO2)C(=O)C3=CC=CC=C3F)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)CN(CC2=CC=CO2)C(=O)C3=CC=CC=C3F)C

InChI

InChI=1S/C22H23FN2O4/c1-4-28-22(27)20-14(2)18(15(3)24-20)13-25(12-16-8-7-11-29-16)21(26)17-9-5-6-10-19(17)23/h5-11,24H,4,12-13H2,1-3H3