2-(1-adamantyl)-N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]ethanamide Openeye Name: 2-(1-adamantyl)-N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]acetamide CAS Name: 2-(1-adamantyl)-N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]acetamide IUPAC Name: 2-(1-adamantyl)-N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]acetamide Traditional Name: 2-(1-adamantyl)-N-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]acetamide Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CC12CC3CC(C1)CC(C3)C2)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C/C(=N\NC(=O)CC12CC3CC(C1)CC(C3)C2)/C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H26N2O3/c1-13(17-2-3-18-19(7-17)26-12-25-18)22-23-20(24)11-21-8-14-4-15(9-21)6-16(5-14)10-21/h2-3,7,14-16H,4-6,8-12H2,1H3,(H,23,24)/b22-13+