N-butyl-N-[5-(4-nitrophenyl)pentan-2-yl]heptan-1-amine

Systemtic Name: N-butyl-N-[5-(4-nitrophenyl)pentan-2-yl]heptan-1-amine Openeye Name: N-butyl-N-[1-methyl-4-(4-nitrophenyl)butyl]heptan-1-amine CAS Name: N-butyl-N-[5-(4-nitrophenyl)pentan-2-yl]-1-heptanamine IUPAC Name: N-butyl-N-[5-(4-nitrophenyl)pentan-2-yl]heptan-1-amine Traditional Name: butyl-heptyl-[1-methyl-4-(4-nitrophenyl)butyl]amine Formula: C22H38N2O2 MolecularWeight: 362.54932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCC)C(C)CCCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCN(CCCC)C(C)CCCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C22H38N2O2/c1-4-6-8-9-10-19-23(18-7-5-2)20(3)12-11-13-21-14-16-22(17-15-21)24(25)26/h14-17,20H,4-13,18-19H2,1-3H3