N-[2-[4-[2-(1-adamantyl)ethanoyl]piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[4-[2-(1-adamantyl)ethanoyl]piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-[2-(1-adamantyl)acetyl]piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-[2-(1-adamantyl)-1-oxoethyl]-1-piperazinyl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-[2-(1-adamantyl)acetyl]piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-[2-(1-adamantyl)acetyl]piperazino]ethyl]-piperonylamide Formula: C26H35N3O4 MolecularWeight: 453.5738

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)CC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)CC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H35N3O4/c30-24(16-26-13-18-9-19(14-26)11-20(10-18)15-26)29-7-5-28(6-8-29)4-3-27-25(31)21-1-2-22-23(12-21)33-17-32-22/h1-2,12,18-20H,3-11,13-17H2,(H,27,31)