1-(3-chloranyl-5-nitro-phenyl)-3-methyl-butan-1-amine

Systemtic Name: 1-(3-chloranyl-5-nitro-phenyl)-3-methyl-butan-1-amine Openeye Name: 1-(3-chloro-5-nitro-phenyl)-3-methyl-butan-1-amine CAS Name: 1-(3-chloro-5-nitrophenyl)-3-methyl-1-butanamine IUPAC Name: 1-(3-chloro-5-nitrophenyl)-3-methylbutan-1-amine Traditional Name: [1-(3-chloro-5-nitro-phenyl)-3-methyl-butyl]amine Formula: C11H15ClN2O2 MolecularWeight: 242.702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15ClN2O2/c1-7(2)3-11(13)8-4-9(12)6-10(5-8)14(15)16/h4-7,11H,3,13H2,1-2H3