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

Systemtic Name: (phenylmethyl) 4-(1-methoxy-1-oxidanylidene-propan-2-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-(2-methoxy-1-methyl-2-oxo-ethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-(1-methoxy-1-oxopropan-2-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(1-methoxy-1-oxopropan-2-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(2-keto-2-methoxy-1-methyl-ethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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