N-[(2-chloranyl-5-nitro-phenyl)methyl]pentan-1-amine

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]pentan-1-amine Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]pentan-1-amine CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-1-pentanamine IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]pentan-1-amine Traditional Name: amyl-(2-chloro-5-nitro-benzyl)amine Formula: C12H17ClN2O2 MolecularWeight: 256.72858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC1=C(C=CC(=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCCNCC1=C(C=CC(=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H17ClN2O2/c1-2-3-4-7-14-9-10-8-11(15(16)17)5-6-12(10)13/h5-6,8,14H,2-4,7,9H2,1H3