(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 4-(1H-indol-3-yl)butanoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 4-(1H-indol-3-yl)butanoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C22H18BrNO4 MolecularWeight: 440.28662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C22H18BrNO4/c23-16-8-9-18-15(10-22(26)28-20(18)11-16)13-27-21(25)7-3-4-14-12-24-19-6-2-1-5-17(14)19/h1-2,5-6,8-12,24H,3-4,7,13H2