methyl 2-(2-azanylethyl)-5-bromanyl-benzoate

Systemtic Name: methyl 2-(2-azanylethyl)-5-bromanyl-benzoate Openeye Name: methyl 2-(2-aminoethyl)-5-bromo-benzoate CAS Name: 2-(2-aminoethyl)-5-bromobenzoic acid methyl ester IUPAC Name: methyl 2-(2-aminoethyl)-5-bromobenzoate Traditional Name: 2-(2-aminoethyl)-5-bromo-benzoic acid methyl ester Formula: C10H12BrNO2 MolecularWeight: 258.11178

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)CCN

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)CCN

InChI

InChI=1S/C10H12BrNO2/c1-14-10(13)9-6-8(11)3-2-7(9)4-5-12/h2-3,6H,4-5,12H2,1H3