methyl 1-butanoyl-4-(4-methoxyphenyl)-3-morpholin-4-yl-pyrrole-2-carboxylate

Systemtic Name: methyl 1-butanoyl-4-(4-methoxyphenyl)-3-morpholin-4-yl-pyrrole-2-carboxylate Openeye Name: methyl 1-butanoyl-4-(4-methoxyphenyl)-3-morpholino-pyrrole-2-carboxylate CAS Name: 4-(4-methoxyphenyl)-3-(4-morpholinyl)-1-(1-oxobutyl)-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-butanoyl-4-(4-methoxyphenyl)-3-morpholin-4-ylpyrrole-2-carboxylate Traditional Name: 1-butyryl-4-(4-methoxyphenyl)-3-morpholino-pyrrole-2-carboxylic acid methyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C=C(C(=C1C(=O)OC)N2CCOCC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC(=O)N1C=C(C(=C1C(=O)OC)N2CCOCC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N2O5/c1-4-5-18(24)23-14-17(15-6-8-16(26-2)9-7-15)19(20(23)21(25)27-3)22-10-12-28-13-11-22/h6-9,14H,4-5,10-13H2,1-3H3