(phenylmethyl) 5-(acetyloxymethyl)-4-(1-methoxy-1-oxidanylidene-propan-2-yl)-3-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 5-(acetyloxymethyl)-4-(1-methoxy-1-oxidanylidene-propan-2-yl)-3-methyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 5-(acetoxymethyl)-4-(2-methoxy-1-methyl-2-oxo-ethyl)-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 5-(acetyloxymethyl)-4-(1-methoxy-1-oxopropan-2-yl)-3-methyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(acetyloxymethyl)-4-(1-methoxy-1-oxopropan-2-yl)-3-methyl-1H-pyrrole-2-carboxylate Traditional Name: 5-(acetoxymethyl)-4-(2-keto-2-methoxy-1-methyl-ethyl)-3-methyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C20H23NO6 MolecularWeight: 373.39972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(C)C(=O)OC)COC(=O)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=C1C(C)C(=O)OC)COC(=O)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H23NO6/c1-12-17(13(2)19(23)25-4)16(11-26-14(3)22)21-18(12)20(24)27-10-15-8-6-5-7-9-15/h5-9,13,21H,10-11H2,1-4H3