13-phenyl-1,6,10,14-tetrazabicyclo[12.3.1]octadecan-11-one

Systemtic Name: 13-phenyl-1,6,10,14-tetrazabicyclo[12.3.1]octadecan-11-one Openeye Name: 13-phenyl-1,6,10,14-tetrazabicyclo[12.3.1]octadecan-11-one CAS Name: 13-phenyl-1,6,10,14-tetrazabicyclo[12.3.1]octadecan-11-one IUPAC Name: 13-phenyl-1,6,10,14-tetrazabicyclo[12.3.1]octadecan-11-one Traditional Name: 13-phenyl-1,6,10,14-tetrazabicyclo[12.3.1]octadecan-11-one Formula: C20H32N4O MolecularWeight: 344.49428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2CCCN(C2)C(CC(=O)NCCCNC1)C3=CC=CC=C3

Isomeric SMILES

C1CCN2CCCN(C2)C(CC(=O)NCCCNC1)C3=CC=CC=C3

InChI

InChI=1S/C20H32N4O/c25-20-16-19(18-8-2-1-3-9-18)24-15-7-14-23(17-24)13-5-4-10-21-11-6-12-22-20/h1-3,8-9,19,21H,4-7,10-17H2,(H,22,25)