azepan-2-one; decanedioic acid; dodecanedioic acid; hexane-1,6-diamine

Systemtic Name: azepan-2-one; decanedioic acid; dodecanedioic acid; hexane-1,6-diamine Openeye Name: azepan-2-one; decanedioic acid; dodecanedioic acid; hexane-1,6-diamine CAS Name: 2-azepanone; decanedioic acid; dodecanedioic acid; hexane-1,6-diamine IUPAC Name: azepan-2-one; decanedioic acid; dodecanedioic acid; hexane-1,6-diamine Traditional Name: 6-aminohexylamine; azepan-2-one; dodecanedioic acid; sebacic acid Formula: C34H67N3O9 MolecularWeight: 661.91048

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NCC1.C(CCCCCC(=O)O)CCCCC(=O)O.C(CCCCC(=O)O)CCCC(=O)O.C(CCCN)CCN

Isomeric SMILES

C1CCC(=O)NCC1.C(CCCCCC(=O)O)CCCCC(=O)O.C(CCCCC(=O)O)CCCC(=O)O.C(CCCN)CCN

InChI

InChI=1S/C12H22O4.C10H18O4.C6H16N2.C6H11NO/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16;11-9(12)7-5-3-1-2-4-6-8-10(13)14;7-5-3-1-2-4-6-8;8-6-4-2-1-3-5-7-6/h1-10H2,(H,13,14)(H,15,16);1-8H2,(H,11,12)(H,13,14);1-8H2;1-5H2,(H,7,8)