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

Systemtic Name: (phenylmethyl) 4-(2-ethoxy-2-oxidanylidene-ethyl)-3-methyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-(2-ethoxy-2-oxo-ethyl)-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 4-(2-ethoxy-2-oxoethyl)-3-methyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(2-ethoxy-2-oxoethyl)-3-methyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(2-ethoxy-2-keto-ethyl)-3-methyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CNC(=C1C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC1=CNC(=C1C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H19NO4/c1-3-21-15(19)9-14-10-18-16(12(14)2)17(20)22-11-13-7-5-4-6-8-13/h4-8,10,18H,3,9,11H2,1-2H3