3-[(2-oxidanylidenechromen-3-yl)carbonylamino]propyl 2-(4-bromanylphenoxy)ethanoate

Systemtic Name: 3-[(2-oxidanylidenechromen-3-yl)carbonylamino]propyl 2-(4-bromanylphenoxy)ethanoate Openeye Name: 3-[(2-oxochromene-3-carbonyl)amino]propyl 2-(4-bromophenoxy)acetate CAS Name: 2-(4-bromophenoxy)acetic acid 3-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]propyl ester IUPAC Name: 3-[(2-oxochromene-3-carbonyl)amino]propyl 2-(4-bromophenoxy)acetate Traditional Name: 2-(4-bromophenoxy)acetic acid 3-[(2-ketochromene-3-carbonyl)amino]propyl ester Formula: C21H18BrNO6 MolecularWeight: 460.27472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)NCCCOC(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)NCCCOC(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H18BrNO6/c22-15-6-8-16(9-7-15)28-13-19(24)27-11-3-10-23-20(25)17-12-14-4-1-2-5-18(14)29-21(17)26/h1-2,4-9,12H,3,10-11,13H2,(H,23,25)