3-[(4-dimethylaminophenyl)methylamino]-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-[(4-dimethylaminophenyl)methylamino]-1H-pyrazole-5-carboxylic acid Openeye Name: 3-[(4-dimethylaminophenyl)methylamino]-1H-pyrazole-5-carboxylic acid CAS Name: 3-[(4-dimethylaminophenyl)methylamino]-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-[(4-dimethylaminophenyl)methylamino]-1H-pyrazole-5-carboxylic acid Traditional Name: 3-[[4-(dimethylamino)benzyl]amino]-1H-pyrazole-5-carboxylic acid Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC2=NNC(=C2)C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC2=NNC(=C2)C(=O)O

InChI

InChI=1S/C13H16N4O2/c1-17(2)10-5-3-9(4-6-10)8-14-12-7-11(13(18)19)15-16-12/h3-7H,8H2,1-2H3,(H,18,19)(H2,14,15,16)