N-butyl-N-[4-(4-nitrophenyl)butyl]heptan-1-amine

Systemtic Name: N-butyl-N-[4-(4-nitrophenyl)butyl]heptan-1-amine Openeye Name: N-butyl-N-[4-(4-nitrophenyl)butyl]heptan-1-amine CAS Name: N-butyl-N-[4-(4-nitrophenyl)butyl]-1-heptanamine IUPAC Name: N-butyl-N-[4-(4-nitrophenyl)butyl]heptan-1-amine Traditional Name: butyl-heptyl-[4-(4-nitrophenyl)butyl]amine Formula: C21H36N2O2 MolecularWeight: 348.52274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCC)CCCCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCN(CCCC)CCCCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C21H36N2O2/c1-3-5-7-8-10-18-22(17-6-4-2)19-11-9-12-20-13-15-21(16-14-20)23(24)25/h13-16H,3-12,17-19H2,1-2H3