1,8-bis(phenylmethyl)-8-aza-1,4,11-triazoniacyclotetradecane

Systemtic Name: 1,8-bis(phenylmethyl)-8-aza-1,4,11-triazoniacyclotetradecane Openeye Name: 1,8-dibenzyl-8-aza-1,4,11-triazoniacyclotetradecane CAS Name: 1,8-bis(phenylmethyl)-8-aza-1,4,11-triazoniacyclotetradecane IUPAC Name: 1,8-dibenzyl-8-aza-1,4,11-triazoniacyclotetradecane Traditional Name: 1,8-dibenzyl-8-aza-1,4,11-triazoniacyclotetradecane Formula: C24H39N4+3 MolecularWeight: 383.59326

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(CCC[NH2+]CC[NH+](C1)CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH2+]CCN(CCC[NH2+]CC[NH+](C1)CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C24H36N4/c1-3-9-23(10-4-1)21-27-17-7-13-26-16-20-28(18-8-14-25-15-19-27)22-24-11-5-2-6-12-24/h1-6,9-12,25-26H,7-8,13-22H2/p+3