4-phenyl-1,5,9-triazacyclotridecan-2-one

Systemtic Name: 4-phenyl-1,5,9-triazacyclotridecan-2-one Openeye Name: 4-phenyl-1,5,9-triazacyclotridecan-2-one CAS Name: 4-phenyl-1,5,9-triazacyclotridecan-2-one IUPAC Name: 4-phenyl-1,5,9-triazacyclotridecan-2-one Traditional Name: 4-phenyl-1,5,9-triazacyclotridecan-2-one Formula: C16H25N3O MolecularWeight: 275.3892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)CC(NCCCNC1)C2=CC=CC=C2

Isomeric SMILES

C1CCNC(=O)CC(NCCCNC1)C2=CC=CC=C2

InChI

InChI=1S/C16H25N3O/c20-16-13-15(14-7-2-1-3-8-14)18-12-6-10-17-9-4-5-11-19-16/h1-3,7-8,15,17-18H,4-6,9-13H2,(H,19,20)