(4-chloranyl-3-nitro-phenyl)methyl-(6-ethoxy-6-oxidanylidene-hexyl)azanium

Systemtic Name: (4-chloranyl-3-nitro-phenyl)methyl-(6-ethoxy-6-oxidanylidene-hexyl)azanium Openeye Name: (4-chloro-3-nitro-phenyl)methyl-(6-ethoxy-6-oxo-hexyl)ammonium CAS Name: (4-chloro-3-nitrophenyl)methyl-(6-ethoxy-6-oxohexyl)ammonium IUPAC Name: (4-chloro-3-nitrophenyl)methyl-(6-ethoxy-6-oxohexyl)azanium Traditional Name: (4-chloro-3-nitro-benzyl)-(6-ethoxy-6-keto-hexyl)ammonium Formula: C15H22ClN2O4+ MolecularWeight: 329.79918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC[NH2+]CC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCCC[NH2+]CC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H21ClN2O4/c1-2-22-15(19)6-4-3-5-9-17-11-12-7-8-13(16)14(10-12)18(20)21/h7-8,10,17H,2-6,9,11H2,1H3/p+1