6-phenethyl-1,4,8,11-tetrazacyclotetradecane-5,7,12-trione

Systemtic Name: 6-phenethyl-1,4,8,11-tetrazacyclotetradecane-5,7,12-trione Openeye Name: 6-phenethyl-1,4,8,11-tetrazacyclotetradecane-5,7,12-trione CAS Name: 6-phenethyl-1,4,8,11-tetrazacyclotetradecane-5,7,12-trione IUPAC Name: 6-phenethyl-1,4,8,11-tetrazacyclotetradecane-5,7,12-trione Traditional Name: 6-phenethyl-1,4,8,11-tetrazacyclotetradecane-5,7,12-trione Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNC(=O)C(C(=O)NCCNC1=O)CCC2=CC=CC=C2

Isomeric SMILES

C1CNCCNC(=O)C(C(=O)NCCNC1=O)CCC2=CC=CC=C2

InChI

InChI=1S/C18H26N4O3/c23-16-8-9-19-10-11-21-17(24)15(18(25)22-13-12-20-16)7-6-14-4-2-1-3-5-14/h1-5,15,19H,6-13H2,(H,20,23)(H,21,24)(H,22,25)