7-[1,6-bis(azanyl)hexyl]azepan-2-one

Systemtic Name: 7-[1,6-bis(azanyl)hexyl]azepan-2-one Openeye Name: 7-(1,6-diaminohexyl)azepan-2-one CAS Name: 7-(1,6-diaminohexyl)-2-azepanone IUPAC Name: 7-(1,6-diaminohexyl)azepan-2-one Traditional Name: 7-(1,6-diaminohexyl)azepan-2-one Formula: C12H25N3O MolecularWeight: 227.3464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NC(C1)C(CCCCCN)N

Isomeric SMILES

C1CCC(=O)NC(C1)C(CCCCCN)N

InChI

InChI=1S/C12H25N3O/c13-9-5-1-2-6-10(14)11-7-3-4-8-12(16)15-11/h10-11H,1-9,13-14H2,(H,15,16)