methyl 3-(tert-butylcarbamoyl)-1-oxidanyl-5-phenyl-pyrrole-2-carboxylate

Systemtic Name: methyl 3-(tert-butylcarbamoyl)-1-oxidanyl-5-phenyl-pyrrole-2-carboxylate Openeye Name: methyl 3-(tert-butylcarbamoyl)-1-hydroxy-5-phenyl-pyrrole-2-carboxylate CAS Name: 3-[(tert-butylamino)-oxomethyl]-1-hydroxy-5-phenyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 3-(tert-butylcarbamoyl)-1-hydroxy-5-phenylpyrrole-2-carboxylate Traditional Name: 3-(tert-butylcarbamoyl)-1-hydroxy-5-phenyl-pyrrole-2-carboxylic acid methyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)O)C(=O)OC

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)O)C(=O)OC

InChI

InChI=1S/C17H20N2O4/c1-17(2,3)18-15(20)12-10-13(11-8-6-5-7-9-11)19(22)14(12)16(21)23-4/h5-10,22H,1-4H3,(H,18,20)