3-[(2-ethylpyrazol-3-yl)methylamino]-4-methyl-benzoate

Systemtic Name: 3-[(2-ethylpyrazol-3-yl)methylamino]-4-methyl-benzoate Openeye Name: 3-[(2-ethylpyrazol-3-yl)methylamino]-4-methyl-benzoate CAS Name: 3-[(2-ethyl-3-pyrazolyl)methylamino]-4-methylbenzoate IUPAC Name: 3-[(2-ethylpyrazol-3-yl)methylamino]-4-methylbenzoate Traditional Name: 3-[(2-ethylpyrazol-3-yl)methylamino]-4-methyl-benzoate Formula: C14H16N3O2- MolecularWeight: 258.29574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)CNC2=C(C=CC(=C2)C(=O)[O-])C

Isomeric SMILES

CCN1C(=CC=N1)CNC2=C(C=CC(=C2)C(=O)[O-])C

InChI

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