(1S)-1-(3-chloranyl-5-nitro-phenyl)-4-methyl-pentan-1-amine

Systemtic Name: (1S)-1-(3-chloranyl-5-nitro-phenyl)-4-methyl-pentan-1-amine Openeye Name: (1S)-1-(3-chloro-5-nitro-phenyl)-4-methyl-pentan-1-amine CAS Name: (1S)-1-(3-chloro-5-nitrophenyl)-4-methyl-1-pentanamine IUPAC Name: (1S)-1-(3-chloro-5-nitrophenyl)-4-methylpentan-1-amine Traditional Name: [(1S)-1-(3-chloro-5-nitro-phenyl)-4-methyl-pentyl]amine Formula: C12H17ClN2O2 MolecularWeight: 256.72858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17ClN2O2/c1-8(2)3-4-12(14)9-5-10(13)7-11(6-9)15(16)17/h5-8,12H,3-4,14H2,1-2H3/t12-/m0/s1