(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (5-methyl-2-phenyl-oxazol-4-yl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (5-methyl-2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (5-methyl-2-phenyl-oxazol-4-yl)methyl ester Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H22N2O5S/c1-16-20(23-21(29-16)17-8-3-2-4-9-17)15-28-22(25)18-10-7-11-19(14-18)30(26,27)24-12-5-6-13-24/h2-4,7-11,14H,5-6,12-13,15H2,1H3