6-[(4-bromanyl-2-methanoyl-phenyl)-[(4-methoxyphenyl)methyl]amino]hexanoic acid

Systemtic Name: 6-[(4-bromanyl-2-methanoyl-phenyl)-[(4-methoxyphenyl)methyl]amino]hexanoic acid Openeye Name: 6-[4-bromo-2-formyl-N-[(4-methoxyphenyl)methyl]anilino]hexanoic acid CAS Name: 6-[4-bromo-2-formyl-N-[(4-methoxyphenyl)methyl]anilino]hexanoic acid IUPAC Name: 6-[4-bromo-2-formyl-N-[(4-methoxyphenyl)methyl]anilino]hexanoic acid Traditional Name: 6-(4-bromo-2-formyl-N-p-anisyl-anilino)hexanoic acid Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CCCCCC(=O)O)C2=C(C=C(C=C2)Br)C=O

Isomeric SMILES

COC1=CC=C(C=C1)CN(CCCCCC(=O)O)C2=C(C=C(C=C2)Br)C=O

InChI

InChI=1S/C21H24BrNO4/c1-27-19-9-6-16(7-10-19)14-23(12-4-2-3-5-21(25)26)20-11-8-18(22)13-17(20)15-24/h6-11,13,15H,2-5,12,14H2,1H3,(H,25,26)