(3E)-N-(2-adamantyl)-3-[2-(4-nitrophenyl)ethanoylhydrazinylidene]butanamide

Systemtic Name: (3E)-N-(2-adamantyl)-3-[2-(4-nitrophenyl)ethanoylhydrazinylidene]butanamide Openeye Name: (3E)-N-(2-adamantyl)-3-[[2-(4-nitrophenyl)acetyl]hydrazono]butanamide CAS Name: (3E)-N-(2-adamantyl)-3-[[2-(4-nitrophenyl)-1-oxoethyl]hydrazinylidene]butanamide IUPAC Name: (3E)-N-(2-adamantyl)-3-[[2-(4-nitrophenyl)acetyl]hydrazinylidene]butanamide Traditional Name: (3E)-N-(2-adamantyl)-3-[[2-(4-nitrophenyl)acetyl]hydrazono]butyramide Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

C/C(=N\NC(=O)CC1=CC=C(C=C1)[N+](=O)[O-])/CC(=O)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C22H28N4O4/c1-13(24-25-21(28)12-14-2-4-19(5-3-14)26(29)30)6-20(27)23-22-17-8-15-7-16(10-17)11-18(22)9-15/h2-5,15-18,22H,6-12H2,1H3,(H,23,27)(H,25,28)/b24-13+