ethyl 1-[(2,4-dichlorophenyl)methyl]-5-[(3-oxidanylidenecyclohexen-1-yl)amino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[(2,4-dichlorophenyl)methyl]-5-[(3-oxidanylidenecyclohexen-1-yl)amino]pyrazole-4-carboxylate Openeye Name: ethyl 1-[(2,4-dichlorophenyl)methyl]-5-[(3-oxocyclohexen-1-yl)amino]pyrazole-4-carboxylate CAS Name: 1-[(2,4-dichlorophenyl)methyl]-5-[(3-oxo-1-cyclohexenyl)amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2,4-dichlorophenyl)methyl]-5-[(3-oxocyclohexen-1-yl)amino]pyrazole-4-carboxylate Traditional Name: 1-(2,4-dichlorobenzyl)-5-[(3-ketocyclohexen-1-yl)amino]pyrazole-4-carboxylic acid ethyl ester Formula: C19H19Cl2N3O3 MolecularWeight: 408.27846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)CC2=C(C=C(C=C2)Cl)Cl)NC3=CC(=O)CCC3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)CC2=C(C=C(C=C2)Cl)Cl)NC3=CC(=O)CCC3

InChI

InChI=1S/C19H19Cl2N3O3/c1-2-27-19(26)16-10-22-24(11-12-6-7-13(20)8-17(12)21)18(16)23-14-4-3-5-15(25)9-14/h6-10,23H,2-5,11H2,1H3