(2-bromanyl-4-chloranyl-phenyl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: (2-bromanyl-4-chloranyl-phenyl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate Openeye Name: (2-bromo-4-chloro-phenyl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate CAS Name: 3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanoic acid (2-bromo-4-chlorophenyl) ester IUPAC Name: (2-bromo-4-chlorophenyl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-pyrrolidinosulfonylphenyl)propionic acid (2-bromo-4-chloro-phenyl) ester Formula: C19H19BrClNO4S MolecularWeight: 472.78046

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C19H19BrClNO4S/c20-17-13-15(21)6-9-18(17)26-19(23)10-5-14-3-7-16(8-4-14)27(24,25)22-11-1-2-12-22/h3-4,6-9,13H,1-2,5,10-12H2