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

Systemtic Name: ethyl 2-(2-ethoxy-2-oxidanylidene-ethyl)-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-benzyl-2-(2-ethoxy-2-oxo-ethyl)pyrrole-3-carboxylate CAS Name: 2-(2-ethoxy-2-oxoethyl)-1-(phenylmethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-2-(2-ethoxy-2-oxoethyl)pyrrole-3-carboxylate Traditional Name: 1-benzyl-2-(2-ethoxy-2-keto-ethyl)pyrrole-3-carboxylic acid ethyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO4/c1-3-22-17(20)12-16-15(18(21)23-4-2)10-11-19(16)13-14-8-6-5-7-9-14/h5-11H,3-4,12-13H2,1-2H3