N-[(3-ethoxy-5-iodanyl-4-phenylmethoxy-phenyl)methyl]cyclopentanamine

Systemtic Name: N-[(3-ethoxy-5-iodanyl-4-phenylmethoxy-phenyl)methyl]cyclopentanamine Openeye Name: N-[(4-benzyloxy-3-ethoxy-5-iodo-phenyl)methyl]cyclopentanamine CAS Name: N-[(3-ethoxy-5-iodo-4-phenylmethoxyphenyl)methyl]cyclopentanamine IUPAC Name: N-[(3-ethoxy-5-iodo-4-phenylmethoxyphenyl)methyl]cyclopentanamine Traditional Name: (4-benzoxy-3-ethoxy-5-iodo-benzyl)-cyclopentyl-amine Formula: C21H26INO2 MolecularWeight: 451.34111

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC2CCCC2)I)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC2CCCC2)I)OCC3=CC=CC=C3

InChI

InChI=1S/C21H26INO2/c1-2-24-20-13-17(14-23-18-10-6-7-11-18)12-19(22)21(20)25-15-16-8-4-3-5-9-16/h3-5,8-9,12-13,18,23H,2,6-7,10-11,14-15H2,1H3