N-[1-[3-(1,2,3,4-tetrazol-1-yl)phenyl]ethyl]heptan-2-amine

Systemtic Name: N-[1-[3-(1,2,3,4-tetrazol-1-yl)phenyl]ethyl]heptan-2-amine Openeye Name: N-[1-[3-(tetrazol-1-yl)phenyl]ethyl]heptan-2-amine CAS Name: N-[1-[3-(1-tetrazolyl)phenyl]ethyl]-2-heptanamine IUPAC Name: N-[1-[3-(tetrazol-1-yl)phenyl]ethyl]heptan-2-amine Traditional Name: 1-methylhexyl-[1-[3-(tetrazol-1-yl)phenyl]ethyl]amine Formula: C16H25N5 MolecularWeight: 287.4032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(C)C1=CC(=CC=C1)N2C=NN=N2

Isomeric SMILES

CCCCCC(C)NC(C)C1=CC(=CC=C1)N2C=NN=N2

InChI

InChI=1S/C16H25N5/c1-4-5-6-8-13(2)18-14(3)15-9-7-10-16(11-15)21-12-17-19-20-21/h7,9-14,18H,4-6,8H2,1-3H3