2-[tert-butyl(methyl)amino]ethyl 3-bromanylbenzoate hydrochloride

Systemtic Name: 2-[tert-butyl(methyl)amino]ethyl 3-bromanylbenzoate hydrochloride Openeye Name: 2-[tert-butyl(methyl)amino]ethyl 3-bromobenzoate hydrochloride CAS Name: 3-bromobenzoic acid 2-[tert-butyl(methyl)amino]ethyl ester hydrochloride IUPAC Name: 2-[tert-butyl(methyl)amino]ethyl 3-bromobenzoate hydrochloride Traditional Name: 3-bromobenzoic acid 2-[tert-butyl(methyl)amino]ethyl ester hydrochloride Formula: C14H21BrClNO2 MolecularWeight: 350.67904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C)CCOC(=O)C1=CC(=CC=C1)Br.Cl

Isomeric SMILES

CC(C)(C)N(C)CCOC(=O)C1=CC(=CC=C1)Br.Cl

InChI

InChI=1S/C14H20BrNO2.ClH/c1-14(2,3)16(4)8-9-18-13(17)11-6-5-7-12(15)10-11;/h5-7,10H,8-9H2,1-4H3;1H