tert-butyl 3-ethyl-5-methanoyl-4-(6-methoxypyridin-2-yl)-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 3-ethyl-5-methanoyl-4-(6-methoxypyridin-2-yl)-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 3-ethyl-5-formyl-4-(6-methoxy-2-pyridyl)-1H-pyrrole-2-carboxylate CAS Name: 3-ethyl-5-formyl-4-(6-methoxy-2-pyridinyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-ethyl-5-formyl-4-(6-methoxypyridin-2-yl)-1H-pyrrole-2-carboxylate Traditional Name: 3-ethyl-5-formyl-4-(6-methoxy-2-pyridyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C2=NC(=CC=C2)OC)C=O)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(NC(=C1C2=NC(=CC=C2)OC)C=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H22N2O4/c1-6-11-15(12-8-7-9-14(19-12)23-5)13(10-21)20-16(11)17(22)24-18(2,3)4/h7-10,20H,6H2,1-5H3