4-chloranyl-2-[[4-[(2-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]phenol

Systemtic Name: 4-chloranyl-2-[[4-[(2-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]phenol Openeye Name: 4-chloro-2-[[4-[(2-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]phenol CAS Name: 4-chloro-2-[[4-[(2-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)-1-piperazinyl]methyl]phenol IUPAC Name: 4-chloro-2-[[4-[(2-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]phenol Traditional Name: 4-chloro-2-[[4-(2-ethoxybenzyl)-3-(2-hydroxyethyl)piperazino]methyl]phenol Formula: C22H29ClN2O3 MolecularWeight: 404.93026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CCN(CC2CCO)CC3=C(C=CC(=C3)Cl)O

Isomeric SMILES

CCOC1=CC=CC=C1CN2CCN(CC2CCO)CC3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C22H29ClN2O3/c1-2-28-22-6-4-3-5-17(22)15-25-11-10-24(16-20(25)9-12-26)14-18-13-19(23)7-8-21(18)27/h3-8,13,20,26-27H,2,9-12,14-16H2,1H3