ethyl 3-[4-chloranyl-3,5-bis(1,3-dimethylpyrazol-4-yl)pyrazol-1-yl]propanoate

Systemtic Name: ethyl 3-[4-chloranyl-3,5-bis(1,3-dimethylpyrazol-4-yl)pyrazol-1-yl]propanoate Openeye Name: ethyl 3-[4-chloro-3,5-bis(1,3-dimethylpyrazol-4-yl)pyrazol-1-yl]propanoate CAS Name: 3-[4-chloro-3,5-bis(1,3-dimethyl-4-pyrazolyl)-1-pyrazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-chloro-3,5-bis(1,3-dimethylpyrazol-4-yl)pyrazol-1-yl]propanoate Traditional Name: 3-[4-chloro-3,5-bis(1,3-dimethylpyrazol-4-yl)pyrazol-1-yl]propionic acid ethyl ester Formula: C18H23ClN6O2 MolecularWeight: 390.86722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C(=C(C(=N1)C2=CN(N=C2C)C)Cl)C3=CN(N=C3C)C

Isomeric SMILES

CCOC(=O)CCN1C(=C(C(=N1)C2=CN(N=C2C)C)Cl)C3=CN(N=C3C)C

InChI

InChI=1S/C18H23ClN6O2/c1-6-27-15(26)7-8-25-18(14-10-24(5)21-12(14)3)16(19)17(22-25)13-9-23(4)20-11(13)2/h9-10H,6-8H2,1-5H3