6-(azepan-1-yl)-N'-[2-(2,6-dimethylphenoxy)ethanoyl]pyridine-3-carbohydrazide

Systemtic Name: 6-(azepan-1-yl)-N'-[2-(2,6-dimethylphenoxy)ethanoyl]pyridine-3-carbohydrazide Openeye Name: 6-(azepan-1-yl)-N'-[2-(2,6-dimethylphenoxy)acetyl]pyridine-3-carbohydrazide CAS Name: 6-(1-azepanyl)-N'-[2-(2,6-dimethylphenoxy)-1-oxoethyl]-3-pyridinecarbohydrazide IUPAC Name: 6-(azepan-1-yl)-N'-[2-(2,6-dimethylphenoxy)acetyl]pyridine-3-carbohydrazide Traditional Name: 6-(azepan-1-yl)-N'-[2-(2,6-dimethylphenoxy)acetyl]nicotinohydrazide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)NNC(=O)C2=CN=C(C=C2)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)NNC(=O)C2=CN=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C22H28N4O3/c1-16-8-7-9-17(2)21(16)29-15-20(27)24-25-22(28)18-10-11-19(23-14-18)26-12-5-3-4-6-13-26/h7-11,14H,3-6,12-13,15H2,1-2H3,(H,24,27)(H,25,28)