5-[4-[4-(phenylmethyl)piperidin-1-yl]but-1-ynyl]-1H-indole-2,3-dione

Systemtic Name: 5-[4-[4-(phenylmethyl)piperidin-1-yl]but-1-ynyl]-1H-indole-2,3-dione Openeye Name: 5-[4-(4-benzyl-1-piperidyl)but-1-ynyl]indoline-2,3-dione CAS Name: 5-[4-[4-(phenylmethyl)-1-piperidinyl]but-1-ynyl]-1H-indole-2,3-dione IUPAC Name: 5-[4-(4-benzylpiperidin-1-yl)but-1-ynyl]-1H-indole-2,3-dione Traditional Name: 5-[4-(4-benzylpiperidino)but-1-ynyl]isatin Formula: C24H24N2O2 MolecularWeight: 372.45956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCC#CC3=CC4=C(C=C3)NC(=O)C4=O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCC#CC3=CC4=C(C=C3)NC(=O)C4=O

InChI

InChI=1S/C24H24N2O2/c27-23-21-17-19(9-10-22(21)25-24(23)28)8-4-5-13-26-14-11-20(12-15-26)16-18-6-2-1-3-7-18/h1-3,6-7,9-10,17,20H,5,11-16H2,(H,25,27,28)