ethyl N-[2-[1-(4-bromophenyl)ethyl]-3-oxidanylidene-1H-pyrazol-5-yl]carbamate

Systemtic Name: ethyl N-[2-[1-(4-bromophenyl)ethyl]-3-oxidanylidene-1H-pyrazol-5-yl]carbamate Openeye Name: ethyl N-[2-[1-(4-bromophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]carbamate CAS Name: N-[2-[1-(4-bromophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[1-(4-bromophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]carbamate Traditional Name: N-[1-[1-(4-bromophenyl)ethyl]-5-keto-3-pyrazolin-3-yl]carbamic acid ethyl ester Formula: C14H16BrN3O3 MolecularWeight: 354.19914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16BrN3O3/c1-3-21-14(20)16-12-8-13(19)18(17-12)9(2)10-4-6-11(15)7-5-10/h4-9,17H,3H2,1-2H3,(H,16,20)