N-[(2-chloranyl-5-nitro-phenyl)methyl]heptan-2-amine

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]heptan-2-amine Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]heptan-2-amine CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-2-heptanamine IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]heptan-2-amine Traditional Name: (2-chloro-5-nitro-benzyl)-(1-methylhexyl)amine Formula: C14H21ClN2O2 MolecularWeight: 284.78174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NCC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCCC(C)NCC1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H21ClN2O2/c1-3-4-5-6-11(2)16-10-12-9-13(17(18)19)7-8-14(12)15/h7-9,11,16H,3-6,10H2,1-2H3