ethyl 3-bromanyl-4-[(2-methylpyrazol-3-yl)methylamino]benzoate

Systemtic Name: ethyl 3-bromanyl-4-[(2-methylpyrazol-3-yl)methylamino]benzoate Openeye Name: ethyl 3-bromo-4-[(2-methylpyrazol-3-yl)methylamino]benzoate CAS Name: 3-bromo-4-[(2-methyl-3-pyrazolyl)methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[(2-methylpyrazol-3-yl)methylamino]benzoate Traditional Name: 3-bromo-4-[(2-methylpyrazol-3-yl)methylamino]benzoic acid ethyl ester Formula: C14H16BrN3O2 MolecularWeight: 338.19974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NCC2=CC=NN2C)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NCC2=CC=NN2C)Br

InChI

InChI=1S/C14H16BrN3O2/c1-3-20-14(19)10-4-5-13(12(15)8-10)16-9-11-6-7-17-18(11)2/h4-8,16H,3,9H2,1-2H3