perchloric acid; 1-(pyridin-2-ylmethyl)-1,4,8,11-tetrazacyclotetradecane

Systemtic Name: perchloric acid; 1-(pyridin-2-ylmethyl)-1,4,8,11-tetrazacyclotetradecane Openeye Name: perchloric acid; 1-(2-pyridylmethyl)-1,4,8,11-tetrazacyclotetradecane CAS Name: perchloric acid; 1-(2-pyridinylmethyl)-1,4,8,11-tetrazacyclotetradecane IUPAC Name: perchloric acid; 1-(pyridin-2-ylmethyl)-1,4,8,11-tetrazacyclotetradecane Traditional Name: perchloric acid; 1-(2-pyridylmethyl)-1,4,8,11-tetrazacyclotetradecane Formula: C16H30ClN5O4 MolecularWeight: 391.8935

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCCCN(CCNC1)CC2=CC=CC=N2.OCl(=O)(=O)=O

Isomeric SMILES

C1CNCCNCCCN(CCNC1)CC2=CC=CC=N2.OCl(=O)(=O)=O

InChI

InChI=1S/C16H29N5.ClHO4/c1-2-9-20-16(5-1)15-21-13-4-8-18-11-10-17-6-3-7-19-12-14-21;2-1(3,4)5/h1-2,5,9,17-19H,3-4,6-8,10-15H2;(H,2,3,4,5)