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

Systemtic Name: N-[5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitro-phenyl]ethanamide Openeye Name: N-[5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitro-phenyl]acetamide CAS Name: N-[5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitrophenyl]acetamide IUPAC Name: N-[5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitrophenyl]acetamide Traditional Name: N-[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-])NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O3/c1-4-5-6-7-10-22-12-16-17(13-22)20(16,3)15-8-9-19(23(25)26)18(11-15)21-14(2)24/h8-9,11,16-17H,4-7,10,12-13H2,1-3H3,(H,21,24)