2-phenyl-N-[2-(1,4,7-triazonan-2-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-phenyl-N-[2-(1,4,7-triazonan-2-ylmethyl)phenyl]ethanamide Openeye Name: 2-phenyl-N-[2-(1,4,7-triazonan-2-ylmethyl)phenyl]acetamide CAS Name: 2-phenyl-N-[2-(1,4,7-triazonan-2-ylmethyl)phenyl]acetamide IUPAC Name: 2-phenyl-N-[2-(1,4,7-triazonan-2-ylmethyl)phenyl]acetamide Traditional Name: 2-phenyl-N-[2-(1,4,7-triazonan-2-ylmethyl)phenyl]acetamide Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(NCCN1)CC2=CC=CC=C2NC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CNCC(NCCN1)CC2=CC=CC=C2NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H28N4O/c26-21(14-17-6-2-1-3-7-17)25-20-9-5-4-8-18(20)15-19-16-23-11-10-22-12-13-24-19/h1-9,19,22-24H,10-16H2,(H,25,26)