3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-5-phenylmethoxycarbonyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-5-phenylmethoxycarbonyl-1H-pyrrole-2-carboxylic acid Openeye Name: 5-benzyloxycarbonyl-3-(2-methoxy-2-oxo-ethyl)-4-(3-methoxy-3-oxo-propyl)-1H-pyrrole-2-carboxylic acid CAS Name: 3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-5-phenylmethoxycarbonyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-5-phenylmethoxycarbonyl-1H-pyrrole-2-carboxylic acid Traditional Name: 5-carbobenzoxy-3-(2-keto-2-methoxy-ethyl)-4-(3-keto-3-methoxy-propyl)-1H-pyrrole-2-carboxylic acid Formula: C20H21NO8 MolecularWeight: 403.38264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=C(NC(=C1CC(=O)OC)C(=O)O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC1=C(NC(=C1CC(=O)OC)C(=O)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H21NO8/c1-27-15(22)9-8-13-14(10-16(23)28-2)17(19(24)25)21-18(13)20(26)29-11-12-6-4-3-5-7-12/h3-7,21H,8-11H2,1-2H3,(H,24,25)