N-[4-[(2-ethynyl-2-adamantyl)oxy]-2-nitro-phenyl]ethanamide

Systemtic Name: N-[4-[(2-ethynyl-2-adamantyl)oxy]-2-nitro-phenyl]ethanamide Openeye Name: N-[4-[(2-ethynyl-2-adamantyl)oxy]-2-nitro-phenyl]acetamide CAS Name: N-[4-[(2-ethynyl-2-adamantyl)oxy]-2-nitrophenyl]acetamide IUPAC Name: N-[4-[(2-ethynyl-2-adamantyl)oxy]-2-nitrophenyl]acetamide Traditional Name: N-[4-[(2-ethynyl-2-adamantyl)oxy]-2-nitro-phenyl]acetamide Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)OC2(C3CC4CC(C3)CC2C4)C#C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)OC2(C3CC4CC(C3)CC2C4)C#C)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O4/c1-3-20(15-7-13-6-14(9-15)10-16(20)8-13)26-17-4-5-18(21-12(2)23)19(11-17)22(24)25/h1,4-5,11,13-16H,6-10H2,2H3,(H,21,23)