tert-butyl 3-ethyl-5-methanoyl-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 3-ethyl-5-methanoyl-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 4-(1-tert-butoxycarbonylpyrrol-2-yl)-3-ethyl-5-formyl-1H-pyrrole-2-carboxylate CAS Name: 3-ethyl-5-formyl-4-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolyl]-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-ethyl-5-formyl-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-2-yl]-1H-pyrrole-2-carboxylate Traditional Name: 4-(1-tert-butoxycarbonylpyrrol-2-yl)-3-ethyl-5-formyl-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C2=CC=CN2C(=O)OC(C)(C)C)C=O)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(NC(=C1C2=CC=CN2C(=O)OC(C)(C)C)C=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H28N2O5/c1-8-13-16(14(12-24)22-17(13)18(25)27-20(2,3)4)15-10-9-11-23(15)19(26)28-21(5,6)7/h9-12,22H,8H2,1-7H3