N-[3-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[2-(1,3-benzodioxole-5-carbonyl)hydrazino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazo]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[2-(1,3-benzodioxole-5-carbonyl)hydrazinyl]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-keto-3-(N'-piperonyloylhydrazino)propyl]adamantane-1-carboxamide Formula: C22H27N3O5 MolecularWeight: 413.46688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)NNC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCC(=O)NNC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H27N3O5/c26-19(24-25-20(27)16-1-2-17-18(8-16)30-12-29-17)3-4-23-21(28)22-9-13-5-14(10-22)7-15(6-13)11-22/h1-2,8,13-15H,3-7,9-12H2,(H,23,28)(H,24,26)(H,25,27)