methyl 4-[[1-(2,4,6-trimethylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-(2,4,6-trimethylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[1-(2,4,6-trimethylphenyl)sulfonyl-2-pyrrolidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]benzoate Traditional Name: 4-[(1-mesitylsulfonylprolyl)amino]benzoic acid methyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCC2C(=O)NC3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCC2C(=O)NC3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C22H26N2O5S/c1-14-12-15(2)20(16(3)13-14)30(27,28)24-11-5-6-19(24)21(25)23-18-9-7-17(8-10-18)22(26)29-4/h7-10,12-13,19H,5-6,11H2,1-4H3,(H,23,25)