3-[4-(5-azanylpentyl)-1,4-diazepan-1-yl]azepan-2-one

Systemtic Name: 3-[4-(5-azanylpentyl)-1,4-diazepan-1-yl]azepan-2-one Openeye Name: 3-[4-(5-aminopentyl)-1,4-diazepan-1-yl]azepan-2-one CAS Name: 3-[4-(5-aminopentyl)-1,4-diazepan-1-yl]-2-azepanone IUPAC Name: 3-[4-(5-aminopentyl)-1,4-diazepan-1-yl]azepan-2-one Traditional Name: 3-[4-(5-aminopentyl)-1,4-diazepan-1-yl]azepan-2-one Formula: C16H32N4O MolecularWeight: 296.45148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N2CCCN(CC2)CCCCCN

Isomeric SMILES

C1CCNC(=O)C(C1)N2CCCN(CC2)CCCCCN

InChI

InChI=1S/C16H32N4O/c17-8-3-1-5-10-19-11-6-12-20(14-13-19)15-7-2-4-9-18-16(15)21/h15H,1-14,17H2,(H,18,21)