3-[5-[bis(phenylmethyl)carbamoyl]pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[5-[bis(phenylmethyl)carbamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[5-(dibenzylcarbamoyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[5-[[bis(phenylmethyl)amino]-oxomethyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[5-(dibenzylcarbamoyl)pyrazol-1-yl]propanoic acid Traditional Name: 3-[5-(dibenzylcarbamoyl)pyrazol-1-yl]propionic acid Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)C3=CC=NN3CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)C3=CC=NN3CCC(=O)O

InChI

InChI=1S/C21H21N3O3/c25-20(26)12-14-24-19(11-13-22-24)21(27)23(15-17-7-3-1-4-8-17)16-18-9-5-2-6-10-18/h1-11,13H,12,14-16H2,(H,25,26)