N2-[(1-butyl-1,2,3,4-tetrazol-5-yl)-phenyl-methyl]cyclohexane-1,2-diamine

Systemtic Name: N2-[(1-butyl-1,2,3,4-tetrazol-5-yl)-phenyl-methyl]cyclohexane-1,2-diamine Openeye Name: N2-[(1-butyltetrazol-5-yl)-phenyl-methyl]cyclohexane-1,2-diamine CAS Name: N2-[(1-butyl-5-tetrazolyl)-phenylmethyl]cyclohexane-1,2-diamine IUPAC Name: 2-N-[(1-butyltetrazol-5-yl)-phenylmethyl]cyclohexane-1,2-diamine Traditional Name: (2-aminocyclohexyl)-[(1-butyltetrazol-5-yl)-phenyl-methyl]amine Formula: C18H28N6 MolecularWeight: 328.45512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)C(C2=CC=CC=C2)NC3CCCCC3N

Isomeric SMILES

CCCCN1C(=NN=N1)C(C2=CC=CC=C2)NC3CCCCC3N

InChI

InChI=1S/C18H28N6/c1-2-3-13-24-18(21-22-23-24)17(14-9-5-4-6-10-14)20-16-12-8-7-11-15(16)19/h4-6,9-10,15-17,20H,2-3,7-8,11-13,19H2,1H3