ethyl 3-azanyl-3-(3-bromanyl-4-ethyl-phenyl)propanoate hydrochloride

Systemtic Name: ethyl 3-azanyl-3-(3-bromanyl-4-ethyl-phenyl)propanoate hydrochloride Openeye Name: ethyl 3-amino-3-(3-bromo-4-ethyl-phenyl)propanoate hydrochloride CAS Name: 3-amino-3-(3-bromo-4-ethylphenyl)propanoic acid ethyl ester hydrochloride IUPAC Name: ethyl 3-amino-3-(3-bromo-4-ethylphenyl)propanoate hydrochloride Traditional Name: 3-amino-3-(3-bromo-4-ethyl-phenyl)propionic acid ethyl ester hydrochloride Formula: C13H19BrClNO2 MolecularWeight: 336.65246

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(CC(=O)OCC)N)Br.Cl

Isomeric SMILES

CCC1=C(C=C(C=C1)C(CC(=O)OCC)N)Br.Cl

InChI

InChI=1S/C13H18BrNO2.ClH/c1-3-9-5-6-10(7-11(9)14)12(15)8-13(16)17-4-2;/h5-7,12H,3-4,8,15H2,1-2H3;1H