quinolin-8-ylmethyl 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate

Systemtic Name: quinolin-8-ylmethyl 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate Openeye Name: 8-quinolylmethyl 1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxylate CAS Name: 1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolecarboxylic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 1-methyl-4-pyrrolidin-1-ylsulfonylpyrrole-2-carboxylate Traditional Name: 1-methyl-4-pyrrolidinosulfonyl-pyrrole-2-carboxylic acid 8-quinolylmethyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC2=CC=CC3=C2N=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC2=CC=CC3=C2N=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H21N3O4S/c1-22-13-17(28(25,26)23-10-2-3-11-23)12-18(22)20(24)27-14-16-7-4-6-15-8-5-9-21-19(15)16/h4-9,12-13H,2-3,10-11,14H2,1H3