N-(1-adamantyl)-2-(4-nitro-2-prop-2-enyl-phenoxy)ethanamide

Systemtic Name: N-(1-adamantyl)-2-(4-nitro-2-prop-2-enyl-phenoxy)ethanamide Openeye Name: N-(1-adamantyl)-2-(2-allyl-4-nitro-phenoxy)acetamide CAS Name: N-(1-adamantyl)-2-(4-nitro-2-prop-2-enylphenoxy)acetamide IUPAC Name: N-(1-adamantyl)-2-(4-nitro-2-prop-2-enylphenoxy)acetamide Traditional Name: N-(1-adamantyl)-2-(2-allyl-4-nitro-phenoxy)acetamide Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=CC(=C1)[N+](=O)[O-])OCC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C=CCC1=C(C=CC(=C1)[N+](=O)[O-])OCC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H26N2O4/c1-2-3-17-9-18(23(25)26)4-5-19(17)27-13-20(24)22-21-10-14-6-15(11-21)8-16(7-14)12-21/h2,4-5,9,14-16H,1,3,6-8,10-13H2,(H,22,24)