ethyl 4-azanyl-3-bromanyl-5-[(tert-butylamino)methyl]benzoate

Systemtic Name: ethyl 4-azanyl-3-bromanyl-5-[(tert-butylamino)methyl]benzoate Openeye Name: ethyl 4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoate CAS Name: 4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoate Traditional Name: 4-amino-3-bromo-5-[(tert-butylamino)methyl]benzoic acid ethyl ester Formula: C14H21BrN2O2 MolecularWeight: 329.23274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)Br)N)CNC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)Br)N)CNC(C)(C)C

InChI

InChI=1S/C14H21BrN2O2/c1-5-19-13(18)9-6-10(8-17-14(2,3)4)12(16)11(15)7-9/h6-7,17H,5,8,16H2,1-4H3