(4-bromanyl-2-methyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methyl N-(4-ethoxyphenyl)carbamate

Systemtic Name: (4-bromanyl-2-methyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methyl N-(4-ethoxyphenyl)carbamate Openeye Name: (4-bromo-2-methyl-5-oxo-1-phenyl-pyrazol-3-yl)methyl N-(4-ethoxyphenyl)carbamate CAS Name: N-(4-ethoxyphenyl)carbamic acid (4-bromo-2-methyl-5-oxo-1-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-bromo-2-methyl-5-oxo-1-phenylpyrazol-3-yl)methyl N-(4-ethoxyphenyl)carbamate Traditional Name: N-p-phenetylcarbamic acid (4-bromo-5-keto-2-methyl-1-phenyl-3-pyrazolin-3-yl)methyl ester Formula: C20H20BrN3O4 MolecularWeight: 446.2945

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)OCC2=C(C(=O)N(N2C)C3=CC=CC=C3)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)OCC2=C(C(=O)N(N2C)C3=CC=CC=C3)Br

InChI

InChI=1S/C20H20BrN3O4/c1-3-27-16-11-9-14(10-12-16)22-20(26)28-13-17-18(21)19(25)24(23(17)2)15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3,(H,22,26)