(4-ethylphenyl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: (4-ethylphenyl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate Openeye Name: (4-ethylphenyl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate CAS Name: 3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanoic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) 3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-pyrrolidinosulfonylphenyl)propionic acid (4-ethylphenyl) ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H25NO4S/c1-2-17-5-10-19(11-6-17)26-21(23)14-9-18-7-12-20(13-8-18)27(24,25)22-15-3-4-16-22/h5-8,10-13H,2-4,9,14-16H2,1H3