2-azanyl-2-(5-bromanyl-2,4-dimethoxy-phenyl)-2-cyclopropyl-ethanoic acid

Systemtic Name: 2-azanyl-2-(5-bromanyl-2,4-dimethoxy-phenyl)-2-cyclopropyl-ethanoic acid Openeye Name: 2-amino-2-(5-bromo-2,4-dimethoxy-phenyl)-2-cyclopropyl-acetic acid CAS Name: 2-amino-2-(5-bromo-2,4-dimethoxyphenyl)-2-cyclopropylacetic acid IUPAC Name: 2-amino-2-(5-bromo-2,4-dimethoxyphenyl)-2-cyclopropylacetic acid Traditional Name: 2-amino-2-(5-bromo-2,4-dimethoxy-phenyl)-2-cyclopropyl-acetic acid Formula: C13H16BrNO4 MolecularWeight: 330.17444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(C2CC2)(C(=O)O)N)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(C2CC2)(C(=O)O)N)Br)OC

InChI

InChI=1S/C13H16BrNO4/c1-18-10-6-11(19-2)9(14)5-8(10)13(15,12(16)17)7-3-4-7/h5-7H,3-4,15H2,1-2H3,(H,16,17)