methyl 4-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methyl]benzoate

Systemtic Name: methyl 4-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methyl]benzoate Openeye Name: methyl 4-[[1-(p-tolylsulfonyl)pyrrolidin-2-yl]methyl]benzoate CAS Name: 4-[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methyl]benzoate Traditional Name: 4-[(1-tosylpyrrolidin-2-yl)methyl]benzoic acid methyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H23NO4S/c1-15-5-11-19(12-6-15)26(23,24)21-13-3-4-18(21)14-16-7-9-17(10-8-16)20(22)25-2/h5-12,18H,3-4,13-14H2,1-2H3