methyl 4-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoyloxy]benzoate

Systemtic Name: methyl 4-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoyloxy]benzoate Openeye Name: methyl 4-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoyloxy]benzoate CAS Name: 4-[1-oxo-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(4-pyrrolidin-1-ylsulfonylphenyl)propanoyloxy]benzoate Traditional Name: 4-[3-(4-pyrrolidinosulfonylphenyl)propanoyloxy]benzoic acid methyl ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO6S/c1-27-21(24)17-7-9-18(10-8-17)28-20(23)13-6-16-4-11-19(12-5-16)29(25,26)22-14-2-3-15-22/h4-5,7-12H,2-3,6,13-15H2,1H3