3-(1,2-diazacycloundecen-3-yl)-1,2-diazacycloundecene; propanedioic acid

Systemtic Name: 3-(1,2-diazacycloundecen-3-yl)-1,2-diazacycloundecene; propanedioic acid Openeye Name: 3-(1,2-diazacycloundecen-3-yl)-1,2-diazacycloundecene; malonic acid CAS Name: 3-(1,2-diazacycloundecen-3-yl)-1,2-diazacycloundecene; propanedioic acid IUPAC Name: 3-(1,2-diazacycloundecen-3-yl)-1,2-diazacycloundecene; propanedioic acid Traditional Name: 3-(1,2-diazacycloundecen-3-yl)-1,2-diazacycloundecene; malonic acid Formula: C21H38N4O4 MolecularWeight: 410.55082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCN=NC(CCC1)C2CCCCCCCCN=N2.C(C(=O)O)C(=O)O

Isomeric SMILES

C1CCCCN=NC(CCC1)C2CCCCCCCCN=N2.C(C(=O)O)C(=O)O

InChI

InChI=1S/C18H34N4.C3H4O4/c1-3-7-11-15-19-21-17(13-9-5-1)18-14-10-6-2-4-8-12-16-20-22-18;4-2(5)1-3(6)7/h17-18H,1-16H2;1H2,(H,4,5)(H,6,7)