4-[(4-ethylphenyl)methylamino]-1-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-[(4-ethylphenyl)methylamino]-1-methyl-pyrazole-3-carboxylic acid Openeye Name: 4-[(4-ethylphenyl)methylamino]-1-methyl-pyrazole-3-carboxylic acid CAS Name: 4-[(4-ethylphenyl)methylamino]-1-methyl-3-pyrazolecarboxylic acid IUPAC Name: 4-[(4-ethylphenyl)methylamino]-1-methylpyrazole-3-carboxylic acid Traditional Name: 4-[(4-ethylbenzyl)amino]-1-methyl-pyrazole-3-carboxylic acid Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC2=CN(N=C2C(=O)O)C

Isomeric SMILES

CCC1=CC=C(C=C1)CNC2=CN(N=C2C(=O)O)C

InChI

InChI=1S/C14H17N3O2/c1-3-10-4-6-11(7-5-10)8-15-12-9-17(2)16-13(12)14(18)19/h4-7,9,15H,3,8H2,1-2H3,(H,18,19)