2-[5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitro-phenyl]ethanamide

Systemtic Name: 2-[5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitro-phenyl]ethanamide Openeye Name: 2-[5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitro-phenyl]acetamide CAS Name: 2-[5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitrophenyl]acetamide IUPAC Name: 2-[5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitrophenyl]acetamide Traditional Name: 2-[5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitro-phenyl]acetamide Formula: C20H29N3O3 MolecularWeight: 359.46256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CC2C(C1)C2(C)C3=CC(=C(C=C3)[N+](=O)[O-])CC(=O)N

Isomeric SMILES

CCCCCCN1CC2C(C1)C2(C)C3=CC(=C(C=C3)[N+](=O)[O-])CC(=O)N

InChI

InChI=1S/C20H29N3O3/c1-3-4-5-6-9-22-12-16-17(13-22)20(16,2)15-7-8-18(23(25)26)14(10-15)11-19(21)24/h7-8,10,16-17H,3-6,9,11-13H2,1-2H3,(H2,21,24)