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

Systemtic Name: 4-[(5-methyl-1,3-diphenyl-pyrazol-4-yl)carbonylamino]butanoate Openeye Name: 4-[(5-methyl-1,3-diphenyl-pyrazole-4-carbonyl)amino]butanoate CAS Name: 4-[[(5-methyl-1,3-diphenyl-4-pyrazolyl)-oxomethyl]amino]butanoate IUPAC Name: 4-[(5-methyl-1,3-diphenylpyrazole-4-carbonyl)amino]butanoate Traditional Name: 4-[(5-methyl-1,3-diphenyl-pyrazole-4-carbonyl)amino]butyrate Formula: C21H20N3O3- MolecularWeight: 362.4018

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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)/p-1