(4-pyrrolidin-1-ylcarbonylphenyl)methyl 4-methylsulfonylbenzoate

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 4-methylsulfonylbenzoate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=CC=C(C=C2)C(=O)N3CCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=CC=C(C=C2)C(=O)N3CCCC3

InChI

InChI=1S/C20H21NO5S/c1-27(24,25)18-10-8-17(9-11-18)20(23)26-14-15-4-6-16(7-5-15)19(22)21-12-2-3-13-21/h4-11H,2-3,12-14H2,1H3