phenyl 2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: phenyl 2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: phenyl 2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-methyl-5-(1-pyrrolidinylsulfonyl)benzoic acid phenyl ester IUPAC Name: phenyl 2-methyl-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-pyrrolidinosulfonyl-benzoic acid phenyl ester Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C18H19NO4S/c1-14-9-10-16(24(21,22)19-11-5-6-12-19)13-17(14)18(20)23-15-7-3-2-4-8-15/h2-4,7-10,13H,5-6,11-12H2,1H3