[4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-methoxy-3-(1-pyrrolidinylsulfonyl)benzoic acid [4-(3,5-dimethyl-1-pyrazolyl)phenyl]methyl ester IUPAC Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl 4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-benzoic acid [4-(3,5-dimethylpyrazol-1-yl)benzyl] ester Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)COC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)COC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C24H27N3O5S/c1-17-14-18(2)27(25-17)21-9-6-19(7-10-21)16-32-24(28)20-8-11-22(31-3)23(15-20)33(29,30)26-12-4-5-13-26/h6-11,14-15H,4-5,12-13,16H2,1-3H3