N'-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]adamantane-1-carbohydrazide

Systemtic Name: N'-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]adamantane-1-carbohydrazide Openeye Name: N'-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]adamantane-1-carbohydrazide CAS Name: N'-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-1-adamantanecarbohydrazide IUPAC Name: N'-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]adamantane-1-carbohydrazide Traditional Name: N'-[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]adamantane-1-carbohydrazide Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=O)C=CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O4/c24-19(4-2-13-1-3-17-18(8-13)27-12-26-17)22-23-20(25)21-9-14-5-15(10-21)7-16(6-14)11-21/h1-4,8,14-16H,5-7,9-12H2,(H,22,24)(H,23,25)/b4-2+