(phenylmethyl) 4-(2-methoxy-2-oxidanylidene-ethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 4-(2-methoxy-2-oxidanylidene-ethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-(2-methoxy-2-oxo-ethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-(2-methoxy-2-oxoethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(2-methoxy-2-oxoethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(2-keto-2-methoxy-ethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CC(=O)OC)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=C1CC(=O)OC)C)C(=O)OCC2=CC=CC=C2

InChI

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