N-[(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)methyl]-3-morpholin-4-yl-propan-1-amine dihydrochloride

Systemtic Name: N-[(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)methyl]-3-morpholin-4-yl-propan-1-amine dihydrochloride Openeye Name: N-[(4-benzyloxy-3-iodo-5-methoxy-phenyl)methyl]-3-morpholino-propan-1-amine dihydrochloride CAS Name: N-[(3-iodo-5-methoxy-4-phenylmethoxyphenyl)methyl]-3-(4-morpholinyl)-1-propanamine dihydrochloride IUPAC Name: N-[(3-iodo-5-methoxy-4-phenylmethoxyphenyl)methyl]-3-morpholin-4-ylpropan-1-amine dihydrochloride Traditional Name: (4-benzoxy-3-iodo-5-methoxy-benzyl)-(3-morpholinopropyl)amine dihydrochloride Formula: C22H31Cl2IN2O3 MolecularWeight: 569.30361

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCCCN2CCOCC2)I)OCC3=CC=CC=C3.Cl.Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCCCN2CCOCC2)I)OCC3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C22H29IN2O3.2ClH/c1-26-21-15-19(16-24-8-5-9-25-10-12-27-13-11-25)14-20(23)22(21)28-17-18-6-3-2-4-7-18;;/h2-4,6-7,14-15,24H,5,8-13,16-17H2,1H3;2*1H