N'-[(E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoyl]adamantane-1-carbohydrazide

Systemtic Name: N'-[(E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoyl]adamantane-1-carbohydrazide Openeye Name: N'-[(E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoyl]adamantane-1-carbohydrazide CAS Name: N'-[(E)-2-cyano-3-(3-methoxyphenyl)-1-oxoprop-2-enyl]-1-adamantanecarbohydrazide IUPAC Name: N'-[(E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoyl]adamantane-1-carbohydrazide Traditional Name: N'-[(E)-2-cyano-3-(3-methoxyphenyl)acryloyl]adamantane-1-carbohydrazide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=C(C#N)C(=O)NNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC=CC(=C1)/C=C(\C#N)/C(=O)NNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H25N3O3/c1-28-19-4-2-3-14(9-19)8-18(13-23)20(26)24-25-21(27)22-10-15-5-16(11-22)7-17(6-15)12-22/h2-4,8-9,15-17H,5-7,10-12H2,1H3,(H,24,26)(H,25,27)/b18-8+