2-[2,6-bis(chloranyl)phenoxy]ethyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate

Systemtic Name: 2-[2,6-bis(chloranyl)phenoxy]ethyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Openeye Name: 2-(2,6-dichlorophenoxy)ethyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate CAS Name: 4-(1-pyrrolidinylsulfonyl)-1H-pyrrole-2-carboxylic acid 2-(2,6-dichlorophenoxy)ethyl ester IUPAC Name: 2-(2,6-dichlorophenoxy)ethyl 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Traditional Name: 4-pyrrolidinosulfonyl-1H-pyrrole-2-carboxylic acid 2-(2,6-dichlorophenoxy)ethyl ester Formula: C17H18Cl2N2O5S MolecularWeight: 433.30622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OCCOC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OCCOC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C17H18Cl2N2O5S/c18-13-4-3-5-14(19)16(13)25-8-9-26-17(22)15-10-12(11-20-15)27(23,24)21-6-1-2-7-21/h3-5,10-11,20H,1-2,6-9H2