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

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]octan-2-amine Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]octan-2-amine CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-2-octanamine IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]octan-2-amine Traditional Name: (2-chloro-5-nitro-benzyl)-(1-methylheptyl)amine Formula: C15H23ClN2O2 MolecularWeight: 298.80832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23ClN2O2/c1-3-4-5-6-7-12(2)17-11-13-10-14(18(19)20)8-9-15(13)16/h8-10,12,17H,3-7,11H2,1-2H3