ethyl 3-bromanyl-4-[(1-methylpyrazol-4-yl)methylamino]benzoate

Systemtic Name: ethyl 3-bromanyl-4-[(1-methylpyrazol-4-yl)methylamino]benzoate Openeye Name: ethyl 3-bromo-4-[(1-methylpyrazol-4-yl)methylamino]benzoate CAS Name: 3-bromo-4-[(1-methyl-4-pyrazolyl)methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[(1-methylpyrazol-4-yl)methylamino]benzoate Traditional Name: 3-bromo-4-[(1-methylpyrazol-4-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=CN(N=C2)C)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NCC2=CN(N=C2)C)Br

InChI

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