1-methyl-N-(4-nitrophenyl)azepan-2-imine hydrochloride

Systemtic Name: 1-methyl-N-(4-nitrophenyl)azepan-2-imine hydrochloride Openeye Name: 1-methyl-N-(4-nitrophenyl)azepan-2-imine hydrochloride CAS Name: 1-methyl-N-(4-nitrophenyl)-2-azepanimine hydrochloride IUPAC Name: 1-methyl-N-(4-nitrophenyl)azepan-2-imine hydrochloride Traditional Name: (1-methylazepan-2-ylidene)-(4-nitrophenyl)amine hydrochloride Formula: C13H18ClN3O2 MolecularWeight: 283.75392

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCCC1=NC2=CC=C(C=C2)[N+](=O)[O-].Cl

Isomeric SMILES

CN1CCCCCC1=NC2=CC=C(C=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C13H17N3O2.ClH/c1-15-10-4-2-3-5-13(15)14-11-6-8-12(9-7-11)16(17)18;/h6-9H,2-5,10H2,1H3;1H