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

Systemtic Name: 3-[4-(3-azanylpropyl)-1,4-diazepan-1-yl]azepan-2-one Openeye Name: 3-[4-(3-aminopropyl)-1,4-diazepan-1-yl]azepan-2-one CAS Name: 3-[4-(3-aminopropyl)-1,4-diazepan-1-yl]-2-azepanone IUPAC Name: 3-[4-(3-aminopropyl)-1,4-diazepan-1-yl]azepan-2-one Traditional Name: 3-[4-(3-aminopropyl)-1,4-diazepan-1-yl]azepan-2-one Formula: C14H28N4O MolecularWeight: 268.39832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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