2-[(4-bromanyl-2,5-dimethoxy-phenyl)methyl-(cyclopropylmethyl)amino]ethanoic acid

Systemtic Name: 2-[(4-bromanyl-2,5-dimethoxy-phenyl)methyl-(cyclopropylmethyl)amino]ethanoic acid Openeye Name: 2-[(4-bromo-2,5-dimethoxy-phenyl)methyl-(cyclopropylmethyl)amino]acetic acid CAS Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methyl-(cyclopropylmethyl)amino]acetic acid IUPAC Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methyl-(cyclopropylmethyl)amino]acetic acid Traditional Name: 2-[(4-bromo-2,5-dimethoxy-benzyl)-(cyclopropylmethyl)amino]acetic acid Formula: C15H20BrNO4 MolecularWeight: 358.2276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CN(CC2CC2)CC(=O)O)OC)Br

Isomeric SMILES

COC1=CC(=C(C=C1CN(CC2CC2)CC(=O)O)OC)Br

InChI

InChI=1S/C15H20BrNO4/c1-20-13-6-12(16)14(21-2)5-11(13)8-17(9-15(18)19)7-10-3-4-10/h5-6,10H,3-4,7-9H2,1-2H3,(H,18,19)