methyl 4-(4-bromophenyl)-1-hexanoyl-3-morpholin-4-yl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-(4-bromophenyl)-1-hexanoyl-3-morpholin-4-yl-pyrrole-2-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-1-hexanoyl-3-morpholino-pyrrole-2-carboxylate CAS Name: 4-(4-bromophenyl)-3-(4-morpholinyl)-1-(1-oxohexyl)-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-1-hexanoyl-3-morpholin-4-ylpyrrole-2-carboxylate Traditional Name: 4-(4-bromophenyl)-1-caproyl-3-morpholino-pyrrole-2-carboxylic acid methyl ester Formula: C22H27BrN2O4 MolecularWeight: 463.36478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1C=C(C(=C1C(=O)OC)N2CCOCC2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCC(=O)N1C=C(C(=C1C(=O)OC)N2CCOCC2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H27BrN2O4/c1-3-4-5-6-19(26)25-15-18(16-7-9-17(23)10-8-16)20(21(25)22(27)28-2)24-11-13-29-14-12-24/h7-10,15H,3-6,11-14H2,1-2H3