7-[2-(4-nitrophenyl)ethyl]azepan-2-amine

Systemtic Name: 7-[2-(4-nitrophenyl)ethyl]azepan-2-amine Openeye Name: 7-[2-(4-nitrophenyl)ethyl]azepan-2-amine CAS Name: 7-[2-(4-nitrophenyl)ethyl]-2-azepanamine IUPAC Name: 7-[2-(4-nitrophenyl)ethyl]azepan-2-amine Traditional Name: [7-[2-(4-nitrophenyl)ethyl]azepan-2-yl]amine Formula: C14H21N3O2 MolecularWeight: 263.33544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(NC(C1)CCC2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

C1CCC(NC(C1)CCC2=CC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C14H21N3O2/c15-14-4-2-1-3-12(16-14)8-5-11-6-9-13(10-7-11)17(18)19/h6-7,9-10,12,14,16H,1-5,8,15H2