(4-bromophenyl) 1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxylate

Systemtic Name: (4-bromophenyl) 1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxylate Openeye Name: (4-bromophenyl) 1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxylate CAS Name: 1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolecarboxylic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 1-methyl-4-morpholin-4-ylsulfonylpyrrole-2-carboxylate Traditional Name: 1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxylic acid (4-bromophenyl) ester Formula: C16H17BrN2O5S MolecularWeight: 429.28558

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC2=CC=C(C=C2)Br)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CN1C=C(C=C1C(=O)OC2=CC=C(C=C2)Br)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H17BrN2O5S/c1-18-11-14(25(21,22)19-6-8-23-9-7-19)10-15(18)16(20)24-13-4-2-12(17)3-5-13/h2-5,10-11H,6-9H2,1H3