3-[4-(4-azanylbutyl)piperazin-1-yl]azepan-2-one

Systemtic Name: 3-[4-(4-azanylbutyl)piperazin-1-yl]azepan-2-one Openeye Name: 3-[4-(4-aminobutyl)piperazin-1-yl]azepan-2-one CAS Name: 3-[4-(4-aminobutyl)-1-piperazinyl]-2-azepanone IUPAC Name: 3-[4-(4-aminobutyl)piperazin-1-yl]azepan-2-one Traditional Name: 3-[4-(4-aminobutyl)piperazino]azepan-2-one Formula: C14H28N4O MolecularWeight: 268.39832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N2CCN(CC2)CCCCN

Isomeric SMILES

C1CCNC(=O)C(C1)N2CCN(CC2)CCCCN

InChI

InChI=1S/C14H28N4O/c15-6-2-4-8-17-9-11-18(12-10-17)13-5-1-3-7-16-14(13)19/h13H,1-12,15H2,(H,16,19)