2-[4-(2-chloranylanthracen-9-yl)oxybutyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(2-chloranylanthracen-9-yl)oxybutyl]isoindole-1,3-dione Openeye Name: 2-[4-[(2-chloro-9-anthryl)oxy]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[(2-chloro-9-anthracenyl)oxy]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(2-chloroanthracen-9-yl)oxybutyl]isoindole-1,3-dione Traditional Name: 2-[4-[(2-chloro-9-anthryl)oxy]butyl]isoindoline-1,3-quinone Formula: C26H20ClNO3 MolecularWeight: 429.8949

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC(=CC3=C2OCCCCN4C(=O)C5=CC=CC=C5C4=O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC(=CC3=C2OCCCCN4C(=O)C5=CC=CC=C5C4=O)Cl

InChI

InChI=1S/C26H20ClNO3/c27-19-12-11-18-15-17-7-1-2-8-20(17)24(23(18)16-19)31-14-6-5-13-28-25(29)21-9-3-4-10-22(21)26(28)30/h1-4,7-12,15-16H,5-6,13-14H2