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

Systemtic Name: 2-[3-(3-chloranylanthracen-9-yl)oxypropyl]isoindole-1,3-dione Openeye Name: 2-[3-[(3-chloro-9-anthryl)oxy]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[(3-chloro-9-anthracenyl)oxy]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(3-chloroanthracen-9-yl)oxypropyl]isoindole-1,3-dione Traditional Name: 2-[3-[(3-chloro-9-anthryl)oxy]propyl]isoindoline-1,3-quinone Formula: C25H18ClNO3 MolecularWeight: 415.86832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=C(C=CC3=C2OCCCN4C(=O)C5=CC=CC=C5C4=O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=C(C=CC3=C2OCCCN4C(=O)C5=CC=CC=C5C4=O)Cl

InChI

InChI=1S/C25H18ClNO3/c26-18-10-11-20-17(15-18)14-16-6-1-2-7-19(16)23(20)30-13-5-12-27-24(28)21-8-3-4-9-22(21)25(27)29/h1-4,6-11,14-15H,5,12-13H2