(1,3-diphenylpyrazol-4-yl)methyl 3-(phenylsulfonyl)propanoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 3-(phenylsulfonyl)propanoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 3-(benzenesulfonyl)propanoate CAS Name: 3-(benzenesulfonyl)propanoic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 3-(benzenesulfonyl)propanoate Traditional Name: 3-besylpropionic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2COC(=O)CCS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2COC(=O)CCS(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O4S/c28-24(16-17-32(29,30)23-14-8-3-9-15-23)31-19-21-18-27(22-12-6-2-7-13-22)26-25(21)20-10-4-1-5-11-20/h1-15,18H,16-17,19H2