2-(phenylmethyl)-1,4,7,10,13-pentazacyclopentadecane

Systemtic Name: 2-(phenylmethyl)-1,4,7,10,13-pentazacyclopentadecane Openeye Name: 2-benzyl-1,4,7,10,13-pentazacyclopentadecane CAS Name: 2-(phenylmethyl)-1,4,7,10,13-pentazacyclopentadecane IUPAC Name: 2-benzyl-1,4,7,10,13-pentazacyclopentadecane Traditional Name: 2-benzyl-1,4,7,10,13-pentazacyclopentadecane Formula: C17H31N5 MolecularWeight: 305.46154

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCC(NCCNCCN1)CC2=CC=CC=C2

Isomeric SMILES

C1CNCCNCC(NCCNCCN1)CC2=CC=CC=C2

InChI

InChI=1S/C17H31N5/c1-2-4-16(5-3-1)14-17-15-21-11-10-19-7-6-18-8-9-20-12-13-22-17/h1-5,17-22H,6-15H2