(tert-butylamino) 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]propanoate

Systemtic Name: (tert-butylamino) 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]propanoate Openeye Name: (tert-butylamino) 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]propanoate CAS Name: 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-pyrazolyl]propanoic acid (tert-butylamino) ester IUPAC Name: (tert-butylamino) 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]propanoate Traditional Name: 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]propionic acid (tert-butylamino) ester Formula: C23H26ClN3O3 MolecularWeight: 427.92384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NOC(=O)CCC1=NN(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)NOC(=O)CCC1=NN(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H26ClN3O3/c1-23(2,3)26-30-22(28)14-9-18-15-21(16-5-7-17(24)8-6-16)27(25-18)19-10-12-20(29-4)13-11-19/h5-8,10-13,15,26H,9,14H2,1-4H3