tert-butyl 2-(4-ethyl-4-methyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-(4-ethyl-4-methyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)pyrrole-1-carboxylate Openeye Name: tert-butyl 2-(4-ethyl-4-methyl-2-oxo-1H-3,1-benzoxazin-6-yl)pyrrole-1-carboxylate CAS Name: 2-(4-ethyl-4-methyl-2-oxo-1H-3,1-benzoxazin-6-yl)-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-ethyl-4-methyl-2-oxo-1H-3,1-benzoxazin-6-yl)pyrrole-1-carboxylate Traditional Name: 2-(4-ethyl-2-keto-4-methyl-1H-3,1-benzoxazin-6-yl)pyrrole-1-carboxylic acid tert-butyl ester Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(C=CC(=C2)C3=CC=CN3C(=O)OC(C)(C)C)NC(=O)O1)C

Isomeric SMILES

CCC1(C2=C(C=CC(=C2)C3=CC=CN3C(=O)OC(C)(C)C)NC(=O)O1)C

InChI

InChI=1S/C20H24N2O4/c1-6-20(5)14-12-13(9-10-15(14)21-17(23)25-20)16-8-7-11-22(16)18(24)26-19(2,3)4/h7-12H,6H2,1-5H3,(H,21,23)