naphthalen-1-ylmethyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate

Systemtic Name: naphthalen-1-ylmethyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Openeye Name: 1-naphthylmethyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate CAS Name: 4-(1-pyrrolidinylsulfonyl)-1H-pyrrole-2-carboxylic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Traditional Name: 4-pyrrolidinosulfonyl-1H-pyrrole-2-carboxylic acid 1-naphthylmethyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C20H20N2O4S/c23-20(26-14-16-8-5-7-15-6-1-2-9-18(15)16)19-12-17(13-21-19)27(24,25)22-10-3-4-11-22/h1-2,5-9,12-13,21H,3-4,10-11,14H2