(3-chloranyl-4-oxidanyl-phenyl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-chloranyl-4-oxidanyl-phenyl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (3-chloro-4-hydroxy-phenyl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone CAS Name: (3-chloro-4-hydroxyphenyl)-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (3-chloro-4-hydroxyphenyl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (3-chloro-4-hydroxy-phenyl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Formula: C19H22ClN2O3+ MolecularWeight: 361.84258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)O)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)O)Cl

InChI

InChI=1S/C19H21ClN2O3/c20-17-14-15(6-7-18(17)23)19(24)22-10-8-21(9-11-22)12-13-25-16-4-2-1-3-5-16/h1-7,14,23H,8-13H2/p+1