2-(9-phenoxycarbonylacridin-10-ium-10-yl)propanoic acid bromide

Systemtic Name: 2-(9-phenoxycarbonylacridin-10-ium-10-yl)propanoic acid bromide Openeye Name: 2-(9-phenoxycarbonylacridin-10-ium-10-yl)propanoic acid bromide CAS Name: 2-[9-[oxo(phenoxy)methyl]-10-acridin-10-iumyl]propanoic acid bromide IUPAC Name: 2-(9-phenoxycarbonylacridin-10-ium-10-yl)propanoic acid bromide Traditional Name: 2-(9-carbophenoxyacridin-10-ium-10-yl)propionic acid bromide Formula: C23H18BrNO4 MolecularWeight: 452.29732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)[N+]1=C2C=CC=CC2=C(C3=CC=CC=C31)C(=O)OC4=CC=CC=C4.[Br-]

Isomeric SMILES

CC(C(=O)O)[N+]1=C2C=CC=CC2=C(C3=CC=CC=C31)C(=O)OC4=CC=CC=C4.[Br-]

InChI

InChI=1S/C23H17NO4.BrH/c1-15(22(25)26)24-19-13-7-5-11-17(19)21(18-12-6-8-14-20(18)24)23(27)28-16-9-3-2-4-10-16;/h2-15H,1H3;1H