[(E)-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methylideneamino] 4-methylbenzoate

Systemtic Name: [(E)-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methylideneamino] 4-methylbenzoate Openeye Name: [(E)-(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyleneamino] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(E)-(5-chloro-1,3-dimethyl-4-pyrazolyl)methylideneamino] ester IUPAC Name: [(E)-(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(E)-(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyleneamino] ester Formula: C14H14ClN3O2 MolecularWeight: 291.73286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)ON=CC2=C(N(N=C2C)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)O/N=C/C2=C(N(N=C2C)C)Cl

InChI

InChI=1S/C14H14ClN3O2/c1-9-4-6-11(7-5-9)14(19)20-16-8-12-10(2)17-18(3)13(12)15/h4-8H,1-3H3/b16-8+