[(Z)-(1,3-dimethyl-5-oxidanylidene-pyrazol-4-ylidene)amino] 4-chloranylbenzoate

Systemtic Name: [(Z)-(1,3-dimethyl-5-oxidanylidene-pyrazol-4-ylidene)amino] 4-chloranylbenzoate Openeye Name: [(Z)-(1,3-dimethyl-5-oxo-pyrazol-4-ylidene)amino] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(Z)-(1,3-dimethyl-5-oxo-4-pyrazolylidene)amino] ester IUPAC Name: [(Z)-(1,3-dimethyl-5-oxopyrazol-4-ylidene)amino] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(Z)-(5-keto-1,3-dimethyl-2-pyrazolin-4-ylidene)amino] ester Formula: C12H10ClN3O3 MolecularWeight: 279.6791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NOC(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC\1=NN(C(=O)/C1=N\OC(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C12H10ClN3O3/c1-7-10(11(17)16(2)14-7)15-19-12(18)8-3-5-9(13)6-4-8/h3-6H,1-2H3/b15-10-