(phenylmethyl) 1-(4-propylphenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 1-(4-propylphenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: benzyl 1-(4-propylphenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(4-propylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(4-propylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-(4-propylphenyl)sulfonylpyrrolidine-2-carboxylic acid benzyl ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H25NO4S/c1-2-7-17-11-13-19(14-12-17)27(24,25)22-15-6-10-20(22)21(23)26-16-18-8-4-3-5-9-18/h3-5,8-9,11-14,20H,2,6-7,10,15-16H2,1H3