(4-pyrazol-1-ylphenyl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(3-chlorophenyl)sulfonylamino]propanoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(3-chlorophenyl)sulfonylamino]propionic acid (4-pyrazol-1-ylbenzyl) ester Formula: C19H18ClN3O4S MolecularWeight: 419.88192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C19H18ClN3O4S/c20-16-3-1-4-18(13-16)28(25,26)22-11-9-19(24)27-14-15-5-7-17(8-6-15)23-12-2-10-21-23/h1-8,10,12-13,22H,9,11,14H2