3,6-dimethyl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone

Systemtic Name: 3,6-dimethyl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone Openeye Name: 3,6-dimethyl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone CAS Name: 3,6-dimethyl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone IUPAC Name: 3,6-dimethyl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-hexone Traditional Name: 3,6-dimethyl-1,4,7,10,13,16-hexazacyclooctadecane-2,5,8,11,14,17-triquinone Formula: C14H22N6O6 MolecularWeight: 370.36108

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC(C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N1)C

Isomeric SMILES

CC1C(=O)NC(C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N1)C

InChI

InChI=1S/C14H22N6O6/c1-7-13(25)18-5-11(23)16-3-9(21)15-4-10(22)17-6-12(24)19-8(2)14(26)20-7/h7-8H,3-6H2,1-2H3,(H,15,21)(H,16,23)(H,17,22)(H,18,25)(H,19,24)(H,20,26)