2-[(4-phenylmethoxyphenyl)methyl]-1,4,7,10,13-pentazacyclopentadecane

Systemtic Name: 2-[(4-phenylmethoxyphenyl)methyl]-1,4,7,10,13-pentazacyclopentadecane Openeye Name: 2-[(4-benzyloxyphenyl)methyl]-1,4,7,10,13-pentazacyclopentadecane CAS Name: 2-[(4-phenylmethoxyphenyl)methyl]-1,4,7,10,13-pentazacyclopentadecane IUPAC Name: 2-[(4-phenylmethoxyphenyl)methyl]-1,4,7,10,13-pentazacyclopentadecane Traditional Name: 2-(4-benzoxybenzyl)-1,4,7,10,13-pentazacyclopentadecane Formula: C24H37N5O MolecularWeight: 411.58348

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCC(NCCNCCN1)CC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1CNCCNCC(NCCNCCN1)CC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C24H37N5O/c1-2-4-22(5-3-1)20-30-24-8-6-21(7-9-24)18-23-19-28-15-14-26-11-10-25-12-13-27-16-17-29-23/h1-9,23,25-29H,10-20H2