5-chloranyl-2-(4-piperidin-1-ylbut-2-ynyl)isoindole-1,3-dione

Systemtic Name: 5-chloranyl-2-(4-piperidin-1-ylbut-2-ynyl)isoindole-1,3-dione Openeye Name: 5-chloro-2-[4-(1-piperidyl)but-2-ynyl]isoindoline-1,3-dione CAS Name: 5-chloro-2-[4-(1-piperidinyl)but-2-ynyl]isoindole-1,3-dione IUPAC Name: 5-chloro-2-(4-piperidin-1-ylbut-2-ynyl)isoindole-1,3-dione Traditional Name: 5-chloro-2-(4-piperidinobut-2-ynyl)isoindoline-1,3-quinone Formula: C17H17ClN2O2 MolecularWeight: 316.78208

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC#CCN2C(=O)C3=C(C2=O)C=C(C=C3)Cl

Isomeric SMILES

C1CCN(CC1)CC#CCN2C(=O)C3=C(C2=O)C=C(C=C3)Cl

InChI

InChI=1S/C17H17ClN2O2/c18-13-6-7-14-15(12-13)17(22)20(16(14)21)11-5-4-10-19-8-2-1-3-9-19/h6-7,12H,1-3,8-11H2