2-[(4-bromophenyl)methyl-(2-methoxyethyl)amino]ethanoic acid

Systemtic Name: 2-[(4-bromophenyl)methyl-(2-methoxyethyl)amino]ethanoic acid Openeye Name: 2-[(4-bromophenyl)methyl-(2-methoxyethyl)amino]acetic acid CAS Name: 2-[(4-bromophenyl)methyl-(2-methoxyethyl)amino]acetic acid IUPAC Name: 2-[(4-bromophenyl)methyl-(2-methoxyethyl)amino]acetic acid Traditional Name: 2-[(4-bromobenzyl)-(2-methoxyethyl)amino]acetic acid Formula: C12H16BrNO3 MolecularWeight: 302.16434

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=C(C=C1)Br)CC(=O)O

Isomeric SMILES

COCCN(CC1=CC=C(C=C1)Br)CC(=O)O

InChI

InChI=1S/C12H16BrNO3/c1-17-7-6-14(9-12(15)16)8-10-2-4-11(13)5-3-10/h2-5H,6-9H2,1H3,(H,15,16)