5-chloranyl-2-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]isoindole-1,3-dione

Systemtic Name: 5-chloranyl-2-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]isoindole-1,3-dione Openeye Name: 5-chloro-2-[1-(1H-indol-3-ylmethyl)-4-piperidyl]isoindoline-1,3-dione CAS Name: 5-chloro-2-[1-(1H-indol-3-ylmethyl)-4-piperidinyl]isoindole-1,3-dione IUPAC Name: 5-chloro-2-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]isoindole-1,3-dione Traditional Name: 5-chloro-2-[1-(1H-indol-3-ylmethyl)-4-piperidyl]isoindoline-1,3-quinone Formula: C22H20ClN3O2 MolecularWeight: 393.8661

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=O)C3=C(C2=O)C=C(C=C3)Cl)CC4=CNC5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1N2C(=O)C3=C(C2=O)C=C(C=C3)Cl)CC4=CNC5=CC=CC=C54

InChI

InChI=1S/C22H20ClN3O2/c23-15-5-6-18-19(11-15)22(28)26(21(18)27)16-7-9-25(10-8-16)13-14-12-24-20-4-2-1-3-17(14)20/h1-6,11-12,16,24H,7-10,13H2