[(2S,5S,9S)-9-(aminomethyl)-5,7,7,12,14,14-hexamethyl-1,4,8,11-tetrazacyclotetradec-11-en-2-yl]methanamine

Systemtic Name: [(2S,5S,9S)-9-(aminomethyl)-5,7,7,12,14,14-hexamethyl-1,4,8,11-tetrazacyclotetradec-11-en-2-yl]methanamine Openeye Name: [(2S,5S,9S)-9-(aminomethyl)-5,7,7,12,14,14-hexamethyl-1,4,8,11-tetrazacyclotetradec-11-en-2-yl]methanamine CAS Name: [(2S,5S,9S)-9-(aminomethyl)-5,7,7,12,14,14-hexamethyl-1,4,8,11-tetrazacyclotetradec-11-en-2-yl]methanamine IUPAC Name: [(2S,5S,9S)-9-(aminomethyl)-5,7,7,12,14,14-hexamethyl-1,4,8,11-tetrazacyclotetradec-11-en-2-yl]methanamine Traditional Name: [(2S,5S,9S)-9-(aminomethyl)-5,7,7,12,14,14-hexamethyl-1,4,8,11-tetrazacyclotetradec-11-en-2-yl]methylamine Formula: C18H40N6 MolecularWeight: 340.5504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(NC(CN=C(CC(NC(CN1)CN)(C)C)C)CN)(C)C

Isomeric SMILES

C[C@H]1CC(N[C@H](CN=C(CC(N[C@H](CN1)CN)(C)C)C)CN)(C)C

InChI

InChI=1S/C18H40N6/c1-13-7-17(3,4)23-16(10-20)12-22-14(2)8-18(5,6)24-15(9-19)11-21-13/h13,15-16,21,23-24H,7-12,19-20H2,1-6H3/t13-,15-,16-/m0/s1