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

Systemtic Name: (4-chloranylnaphthalen-1-yl) 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate Openeye Name: (4-chloro-1-naphthyl) 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate CAS Name: 1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolecarboxylic acid (4-chloro-1-naphthalenyl) ester IUPAC Name: (4-chloronaphthalen-1-yl) 1-methyl-4-pyrrolidin-1-ylsulfonylpyrrole-2-carboxylate Traditional Name: 1-methyl-4-pyrrolidinosulfonyl-pyrrole-2-carboxylic acid (4-chloro-1-naphthyl) ester Formula: C20H19ClN2O4S MolecularWeight: 418.89386

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC2=CC=C(C3=CC=CC=C32)Cl)S(=O)(=O)N4CCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)OC2=CC=C(C3=CC=CC=C32)Cl)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H19ClN2O4S/c1-22-13-14(28(25,26)23-10-4-5-11-23)12-18(22)20(24)27-19-9-8-17(21)15-6-2-3-7-16(15)19/h2-3,6-9,12-13H,4-5,10-11H2,1H3