2-chloranyl-N-(1,4,5,6,7,8-hexahydro-1,3-diazocin-3-ium-2-yl)benzamide

Systemtic Name: 2-chloranyl-N-(1,4,5,6,7,8-hexahydro-1,3-diazocin-3-ium-2-yl)benzamide Openeye Name: 2-chloro-N-(1,4,5,6,7,8-hexahydro-1,3-diazocin-3-ium-2-yl)benzamide CAS Name: 2-chloro-N-(1,4,5,6,7,8-hexahydro-1,3-diazocin-3-ium-2-yl)benzamide IUPAC Name: 2-chloro-N-(1,4,5,6,7,8-hexahydro-1,3-diazocin-3-ium-2-yl)benzamide Traditional Name: 2-chloro-N-(1,4,5,6,7,8-hexahydro-1,3-diazocin-3-ium-2-yl)benzamide Formula: C13H17ClN3O+ MolecularWeight: 266.74658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=[NH+]CC1)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

C1CCNC(=[NH+]CC1)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C13H16ClN3O/c14-11-7-3-2-6-10(11)12(18)17-13-15-8-4-1-5-9-16-13/h2-3,6-7H,1,4-5,8-9H2,(H2,15,16,17,18)/p+1