[5-(methoxymethyl)-2-phenyl-pyrazol-3-yl] 2-bromanylbenzoate

Systemtic Name: [5-(methoxymethyl)-2-phenyl-pyrazol-3-yl] 2-bromanylbenzoate Openeye Name: [5-(methoxymethyl)-2-phenyl-pyrazol-3-yl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [5-(methoxymethyl)-2-phenyl-3-pyrazolyl] ester IUPAC Name: [5-(methoxymethyl)-2-phenylpyrazol-3-yl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [5-(methoxymethyl)-2-phenyl-pyrazol-3-yl] ester Formula: C18H15BrN2O3 MolecularWeight: 387.2273

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN(C(=C1)OC(=O)C2=CC=CC=C2Br)C3=CC=CC=C3

Isomeric SMILES

COCC1=NN(C(=C1)OC(=O)C2=CC=CC=C2Br)C3=CC=CC=C3

InChI

InChI=1S/C18H15BrN2O3/c1-23-12-13-11-17(21(20-13)14-7-3-2-4-8-14)24-18(22)15-9-5-6-10-16(15)19/h2-11H,12H2,1H3