1-[2-(1,3-benzodioxol-5-ylmethyl)-1,3-bis(oxidanylidene)isoindol-4-yl]-N-cycloheptyl-piperidine-4-carboxamide

Systemtic Name: 1-[2-(1,3-benzodioxol-5-ylmethyl)-1,3-bis(oxidanylidene)isoindol-4-yl]-N-cycloheptyl-piperidine-4-carboxamide Openeye Name: 1-[2-(1,3-benzodioxol-5-ylmethyl)-1,3-dioxo-isoindolin-4-yl]-N-cycloheptyl-piperidine-4-carboxamide CAS Name: 1-[2-(1,3-benzodioxol-5-ylmethyl)-1,3-dioxo-4-isoindolyl]-N-cycloheptyl-4-piperidinecarboxamide IUPAC Name: 1-[2-(1,3-benzodioxol-5-ylmethyl)-1,3-dioxoisoindol-4-yl]-N-cycloheptylpiperidine-4-carboxamide Traditional Name: N-cycloheptyl-1-(1,3-diketo-2-piperonyl-isoindolin-4-yl)isonipecotamide Formula: C29H33N3O5 MolecularWeight: 503.58942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H33N3O5/c33-27(30-21-6-3-1-2-4-7-21)20-12-14-31(15-13-20)23-9-5-8-22-26(23)29(35)32(28(22)34)17-19-10-11-24-25(16-19)37-18-36-24/h5,8-11,16,20-21H,1-4,6-7,12-15,17-18H2,(H,30,33)