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

Systemtic Name: N-[1-[3-(1,2,3,4-tetrazol-1-yl)phenyl]ethyl]butan-1-amine Openeye Name: N-[1-[3-(tetrazol-1-yl)phenyl]ethyl]butan-1-amine CAS Name: N-[1-[3-(1-tetrazolyl)phenyl]ethyl]-1-butanamine IUPAC Name: N-[1-[3-(tetrazol-1-yl)phenyl]ethyl]butan-1-amine Traditional Name: butyl-[1-[3-(tetrazol-1-yl)phenyl]ethyl]amine Formula: C13H19N5 MolecularWeight: 245.32346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(C)C1=CC(=CC=C1)N2C=NN=N2

Isomeric SMILES

CCCCNC(C)C1=CC(=CC=C1)N2C=NN=N2

InChI

InChI=1S/C13H19N5/c1-3-4-8-14-11(2)12-6-5-7-13(9-12)18-10-15-16-17-18/h5-7,9-11,14H,3-4,8H2,1-2H3