N,N'-bis(2,2-dimethylpropyl)propane-1,3-diamine; 4-nitrobenzamide

Systemtic Name: N,N'-bis(2,2-dimethylpropyl)propane-1,3-diamine; 4-nitrobenzamide Openeye Name: N,N'-bis(2,2-dimethylpropyl)propane-1,3-diamine; 4-nitrobenzamide CAS Name: N,N'-bis(2,2-dimethylpropyl)propane-1,3-diamine; 4-nitrobenzamide IUPAC Name: N,N'-bis(2,2-dimethylpropyl)propane-1,3-diamine; 4-nitrobenzamide Traditional Name: neopentyl-[3-(neopentylamino)propyl]amine; 4-nitrobenzamide Formula: C27H42N6O6 MolecularWeight: 546.65898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNCCCNCC(C)(C)C.C1=CC(=CC=C1C(=O)N)[N+](=O)[O-].C1=CC(=CC=C1C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)CNCCCNCC(C)(C)C.C1=CC(=CC=C1C(=O)N)[N+](=O)[O-].C1=CC(=CC=C1C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C13H30N2.2C7H6N2O3/c1-12(2,3)10-14-8-7-9-15-11-13(4,5)6;2*8-7(10)5-1-3-6(4-2-5)9(11)12/h14-15H,7-11H2,1-6H3;2*1-4H,(H2,8,10)