5-chloranyl-2-(3-piperidin-1-ylpropyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione hydrobromide

Systemtic Name: 5-chloranyl-2-(3-piperidin-1-ylpropyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione hydrobromide Openeye Name: 5-chloro-2-[3-(1-piperidyl)propyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione hydrobromide CAS Name: 5-chloro-2-[3-(1-piperidinyl)propyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione hydrobromide IUPAC Name: 5-chloro-2-(3-piperidin-1-ylpropyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione hydrobromide Traditional Name: 5-chloro-2-(3-piperidinopropyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone hydrobromide Formula: C16H24BrClN2O2 MolecularWeight: 391.73096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN2C(=O)C3CC=C(CC3C2=O)Cl.Br

Isomeric SMILES

C1CCN(CC1)CCCN2C(=O)C3CC=C(CC3C2=O)Cl.Br

InChI

InChI=1S/C16H23ClN2O2.BrH/c17-12-5-6-13-14(11-12)16(21)19(15(13)20)10-4-9-18-7-2-1-3-8-18;/h5,13-14H,1-4,6-11H2;1H