methyl 2-[(1S)-1-azanylethyl]-5-bromanyl-benzoate

Systemtic Name: methyl 2-[(1S)-1-azanylethyl]-5-bromanyl-benzoate Openeye Name: methyl 2-[(1S)-1-aminoethyl]-5-bromo-benzoate CAS Name: 2-[(1S)-1-aminoethyl]-5-bromobenzoic acid methyl ester IUPAC Name: methyl 2-[(1S)-1-aminoethyl]-5-bromobenzoate Traditional Name: 2-[(1S)-1-aminoethyl]-5-bromo-benzoic acid methyl ester Formula: C10H12BrNO2 MolecularWeight: 258.11178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)Br)C(=O)OC)N

Isomeric SMILES

C[C@@H](C1=C(C=C(C=C1)Br)C(=O)OC)N

InChI

InChI=1S/C10H12BrNO2/c1-6(12)8-4-3-7(11)5-9(8)10(13)14-2/h3-6H,12H2,1-2H3/t6-/m0/s1