(6-bromanylnaphthalen-2-yl) 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate

Systemtic Name: (6-bromanylnaphthalen-2-yl) 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate Openeye Name: (6-bromo-2-naphthyl) 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate CAS Name: 1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolecarboxylic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) 1-methyl-4-pyrrolidin-1-ylsulfonylpyrrole-2-carboxylate Traditional Name: 1-methyl-4-pyrrolidinosulfonyl-pyrrole-2-carboxylic acid (6-bromo-2-naphthyl) ester Formula: C20H19BrN2O4S MolecularWeight: 463.34486

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC2=CC3=C(C=C2)C=C(C=C3)Br)S(=O)(=O)N4CCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)OC2=CC3=C(C=C2)C=C(C=C3)Br)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H19BrN2O4S/c1-22-13-18(28(25,26)23-8-2-3-9-23)12-19(22)20(24)27-17-7-5-14-10-16(21)6-4-15(14)11-17/h4-7,10-13H,2-3,8-9H2,1H3