(3-methylphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (3-methylphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: m-tolylmethyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (3-methylbenzyl) ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H21NO4S/c1-15-5-4-6-16(13-15)14-24-19(21)17-7-9-18(10-8-17)25(22,23)20-11-2-3-12-20/h4-10,13H,2-3,11-12,14H2,1H3