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6-(phenylmethyl)-1,4,8,11-tetrazacyclotetradecane-5,7-dione

6-(phenylmethyl)-1,4,8,11-tetrazacyclotetradecane-5,7-dione

Systemtic Name:6-(phenylmethyl)-1,4,8,11-tetrazacyclotetradecane-5,7-dione
Openeye Name:6-benzyl-1,4,8,11-tetrazacyclotetradecane-5,7-dione
CAS Name:6-(phenylmethyl)-1,4,8,11-tetrazacyclotetradecane-5,7-dione
IUPAC Name:6-benzyl-1,4,8,11-tetrazacyclotetradecane-5,7-dione
Traditional Name:6-benzyl-1,4,8,11-tetrazacyclotetradecane-5,7-quinone
Formula: C17H26N4O2
MolecularWeight: 318.41394
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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNC(=O)C(C(=O)NCCNC1)CC2=CC=CC=C2


Isomeric SMILES

C1CNCCNC(=O)C(C(=O)NCCNC1)CC2=CC=CC=C2


InChI

InChI=1S/C17H26N4O2/c22-16-15(13-14-5-2-1-3-6-14)17(23)21-12-10-19-8-4-7-18-9-11-20-16/h1-3,5-6,15,18-19H,4,7-13H2,(H,20,22)(H,21,23)


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