(1S)-1-(4-chloranyl-3-nitro-phenyl)-N,N-bis(2-methylpropyl)ethane-1,2-diamine

Systemtic Name: (1S)-1-(4-chloranyl-3-nitro-phenyl)-N,N-bis(2-methylpropyl)ethane-1,2-diamine Openeye Name: (1S)-1-(4-chloro-3-nitro-phenyl)-N,N-diisobutyl-ethane-1,2-diamine CAS Name: (1S)-1-(4-chloro-3-nitrophenyl)-N,N-bis(2-methylpropyl)ethane-1,2-diamine IUPAC Name: (1S)-1-(4-chloro-3-nitrophenyl)-N,N-bis(2-methylpropyl)ethane-1,2-diamine Traditional Name: [(1S)-2-amino-1-(4-chloro-3-nitro-phenyl)ethyl]-diisobutyl-amine Formula: C16H26ClN3O2 MolecularWeight: 327.84954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26ClN3O2/c1-11(2)9-19(10-12(3)4)16(8-18)13-5-6-14(17)15(7-13)20(21)22/h5-7,11-12,16H,8-10,18H2,1-4H3/t16-/m1/s1