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

Systemtic Name: 5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitro-aniline Openeye Name: 5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitro-aniline CAS Name: 5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitroaniline IUPAC Name: 5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitroaniline Traditional Name: [5-(3-hexyl-6-methyl-3-azabicyclo[3.1.0]hexan-6-yl)-2-nitro-phenyl]amine Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O2/c1-3-4-5-6-9-20-11-14-15(12-20)18(14,2)13-7-8-17(21(22)23)16(19)10-13/h7-8,10,14-15H,3-6,9,11-12,19H2,1-2H3