(1-phenylpyrazol-4-yl)methyl 3-(phenylsulfonyl)propanoate

Systemtic Name: (1-phenylpyrazol-4-yl)methyl 3-(phenylsulfonyl)propanoate Openeye Name: (1-phenylpyrazol-4-yl)methyl 3-(benzenesulfonyl)propanoate CAS Name: 3-(benzenesulfonyl)propanoic acid (1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (1-phenylpyrazol-4-yl)methyl 3-(benzenesulfonyl)propanoate Traditional Name: 3-besylpropionic acid (1-phenylpyrazol-4-yl)methyl ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)COC(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)COC(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O4S/c22-19(11-12-26(23,24)18-9-5-2-6-10-18)25-15-16-13-20-21(14-16)17-7-3-1-4-8-17/h1-10,13-14H,11-12,15H2