4-[(5-methyl-1,3-diphenyl-pyrazol-4-yl)carbonylamino]butanoic acid

Systemtic Name: 4-[(5-methyl-1,3-diphenyl-pyrazol-4-yl)carbonylamino]butanoic acid Openeye Name: 4-[(5-methyl-1,3-diphenyl-pyrazole-4-carbonyl)amino]butanoic acid CAS Name: 4-[[(5-methyl-1,3-diphenyl-4-pyrazolyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(5-methyl-1,3-diphenylpyrazole-4-carbonyl)amino]butanoic acid Traditional Name: 4-[(5-methyl-1,3-diphenyl-pyrazole-4-carbonyl)amino]butyric acid Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCCCC(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCCCC(=O)O

InChI

InChI=1S/C21H21N3O3/c1-15-19(21(27)22-14-8-13-18(25)26)20(16-9-4-2-5-10-16)23-24(15)17-11-6-3-7-12-17/h2-7,9-12H,8,13-14H2,1H3,(H,22,27)(H,25,26)