ethyl 5-(2-ethoxy-2-oxidanylidene-ethyl)-4-methyl-1-(phenylmethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(2-ethoxy-2-oxidanylidene-ethyl)-4-methyl-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-benzyl-5-(2-ethoxy-2-oxo-ethyl)-4-methyl-pyrrole-3-carboxylate CAS Name: 5-(2-ethoxy-2-oxoethyl)-4-methyl-1-(phenylmethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-(2-ethoxy-2-oxoethyl)-4-methylpyrrole-3-carboxylate Traditional Name: 1-benzyl-5-(2-ethoxy-2-keto-ethyl)-4-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=CN1CC2=CC=CC=C2)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)CC1=C(C(=CN1CC2=CC=CC=C2)C(=O)OCC)C

InChI

InChI=1S/C19H23NO4/c1-4-23-18(21)11-17-14(3)16(19(22)24-5-2)13-20(17)12-15-9-7-6-8-10-15/h6-10,13H,4-5,11-12H2,1-3H3