O4-ethyl O2-(phenylmethyl) 5-(2-ethoxy-2-oxidanylidene-ethyl)-3-[2-(3-fluorophenyl)ethyl]-1-methyl-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-(phenylmethyl) 5-(2-ethoxy-2-oxidanylidene-ethyl)-3-[2-(3-fluorophenyl)ethyl]-1-methyl-pyrrole-2,4-dicarboxylate Openeye Name: O2-benzyl O4-ethyl 5-(2-ethoxy-2-oxo-ethyl)-3-[2-(3-fluorophenyl)ethyl]-1-methyl-pyrrole-2,4-dicarboxylate CAS Name: 5-(2-ethoxy-2-oxoethyl)-3-[2-(3-fluorophenyl)ethyl]-1-methylpyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-(phenylmethyl) ester IUPAC Name: 2-O-benzyl 4-O-ethyl 5-(2-ethoxy-2-oxoethyl)-3-[2-(3-fluorophenyl)ethyl]-1-methylpyrrole-2,4-dicarboxylate Traditional Name: 5-(2-ethoxy-2-keto-ethyl)-3-[2-(3-fluorophenyl)ethyl]-1-methyl-pyrrole-2,4-dicarboxylic acid O2-benzyl ester O4-ethyl ester Formula: C28H30FNO6 MolecularWeight: 495.539303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=C(N1C)C(=O)OCC2=CC=CC=C2)CCC3=CC(=CC=C3)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=C(C(=C(N1C)C(=O)OCC2=CC=CC=C2)CCC3=CC(=CC=C3)F)C(=O)OCC

InChI

InChI=1S/C28H30FNO6/c1-4-34-24(31)17-23-25(27(32)35-5-2)22(15-14-19-12-9-13-21(29)16-19)26(30(23)3)28(33)36-18-20-10-7-6-8-11-20/h6-13,16H,4-5,14-15,17-18H2,1-3H3