2-[(4S)-1,3-dimethyl-5-oxidanylidene-4H-pyrazol-4-yl]ethyl N-(3,4-dichlorophenyl)carbamate

Systemtic Name: 2-[(4S)-1,3-dimethyl-5-oxidanylidene-4H-pyrazol-4-yl]ethyl N-(3,4-dichlorophenyl)carbamate Openeye Name: 2-[(4S)-1,3-dimethyl-5-oxo-4H-pyrazol-4-yl]ethyl N-(3,4-dichlorophenyl)carbamate CAS Name: N-(3,4-dichlorophenyl)carbamic acid 2-[(4S)-1,3-dimethyl-5-oxo-4H-pyrazol-4-yl]ethyl ester IUPAC Name: 2-[(4S)-1,3-dimethyl-5-oxo-4H-pyrazol-4-yl]ethyl N-(3,4-dichlorophenyl)carbamate Traditional Name: N-(3,4-dichlorophenyl)carbamic acid 2-[(4S)-5-keto-1,3-dimethyl-2-pyrazolin-4-yl]ethyl ester Formula: C14H15Cl2N3O3 MolecularWeight: 344.1932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1CCOC(=O)NC2=CC(=C(C=C2)Cl)Cl)C

Isomeric SMILES

CC1=NN(C(=O)[C@H]1CCOC(=O)NC2=CC(=C(C=C2)Cl)Cl)C

InChI

InChI=1S/C14H15Cl2N3O3/c1-8-10(13(20)19(2)18-8)5-6-22-14(21)17-9-3-4-11(15)12(16)7-9/h3-4,7,10H,5-6H2,1-2H3,(H,17,21)/t10-/m0/s1