methyl 4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]butanoate CAS Name: 4-[[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[3-(4-methoxyphenyl)-1-phenylpyrazole-4-carbonyl]amino]butanoate Traditional Name: 4-[[3-(4-methoxyphenyl)-1-phenyl-pyrazole-4-carbonyl]amino]butyric acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)NCCCC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2C(=O)NCCCC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O4/c1-28-18-12-10-16(11-13-18)21-19(22(27)23-14-6-9-20(26)29-2)15-25(24-21)17-7-4-3-5-8-17/h3-5,7-8,10-13,15H,6,9,14H2,1-2H3,(H,23,27)