2-iodanyl-6-methoxy-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]phenol

Systemtic Name: 2-iodanyl-6-methoxy-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]phenol Openeye Name: 2-iodo-6-methoxy-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]phenol CAS Name: 2-iodo-6-methoxy-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]methyl]phenol IUPAC Name: 2-iodo-6-methoxy-4-[[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methyl]phenol Traditional Name: 2-iodo-6-methoxy-4-[[4-(2,3,4-trimethoxybenzyl)piperazino]methyl]phenol Formula: C22H29IN2O5 MolecularWeight: 528.38053

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)CC3=CC(=C(C(=C3)I)O)OC)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)CC3=CC(=C(C(=C3)I)O)OC)OC)OC

InChI

InChI=1S/C22H29IN2O5/c1-27-18-6-5-16(21(29-3)22(18)30-4)14-25-9-7-24(8-10-25)13-15-11-17(23)20(26)19(12-15)28-2/h5-6,11-12,26H,7-10,13-14H2,1-4H3