ethyl N-[2-[(4-bromanyl-3-chloranyl-phenyl)methyl]-4-methyl-3-oxidanylidene-1H-pyrazol-5-yl]carbamate

Systemtic Name: ethyl N-[2-[(4-bromanyl-3-chloranyl-phenyl)methyl]-4-methyl-3-oxidanylidene-1H-pyrazol-5-yl]carbamate Openeye Name: ethyl N-[2-[(4-bromo-3-chloro-phenyl)methyl]-4-methyl-3-oxo-1H-pyrazol-5-yl]carbamate CAS Name: N-[2-[(4-bromo-3-chlorophenyl)methyl]-4-methyl-3-oxo-1H-pyrazol-5-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[(4-bromo-3-chlorophenyl)methyl]-4-methyl-3-oxo-1H-pyrazol-5-yl]carbamate Traditional Name: N-[1-(4-bromo-3-chloro-benzyl)-5-keto-4-methyl-3-pyrazolin-3-yl]carbamic acid ethyl ester Formula: C14H15BrClN3O3 MolecularWeight: 388.6442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=C(C(=O)N(N1)CC2=CC(=C(C=C2)Br)Cl)C

Isomeric SMILES

CCOC(=O)NC1=C(C(=O)N(N1)CC2=CC(=C(C=C2)Br)Cl)C

InChI

InChI=1S/C14H15BrClN3O3/c1-3-22-14(21)17-12-8(2)13(20)19(18-12)7-9-4-5-10(15)11(16)6-9/h4-6,18H,3,7H2,1-2H3,(H,17,21)