2-[[3-(4-dimethylaminophenyl)-4,5-dihydro-1H-pyrazol-5-yl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[3-(4-dimethylaminophenyl)-4,5-dihydro-1H-pyrazol-5-yl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[3-(4-dimethylaminophenyl)-4,5-dihydro-1H-pyrazol-5-yl]amino]-3-methyl-butanoic acid CAS Name: 2-[[3-(4-dimethylaminophenyl)-4,5-dihydro-1H-pyrazol-5-yl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[3-(4-dimethylaminophenyl)-4,5-dihydro-1H-pyrazol-5-yl]amino]-3-methylbutanoic acid Traditional Name: 2-[[5-(4-dimethylaminophenyl)-2-pyrazolin-3-yl]amino]-3-methyl-butyric acid Formula: C16H24N4O2 MolecularWeight: 304.38736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC1CC(=NN1)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C)C(C(=O)O)NC1CC(=NN1)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C16H24N4O2/c1-10(2)15(16(21)22)17-14-9-13(18-19-14)11-5-7-12(8-6-11)20(3)4/h5-8,10,14-15,17,19H,9H2,1-4H3,(H,21,22)