1-[4-(2-chloranyl-5-methyl-phenoxy)phenyl]piperazin-4-ium

Systemtic Name: 1-[4-(2-chloranyl-5-methyl-phenoxy)phenyl]piperazin-4-ium Openeye Name: 1-[4-(2-chloro-5-methyl-phenoxy)phenyl]piperazin-4-ium CAS Name: 1-[4-(2-chloro-5-methylphenoxy)phenyl]piperazin-4-ium IUPAC Name: 1-[4-(2-chloro-5-methylphenoxy)phenyl]piperazin-4-ium Traditional Name: 1-[4-(2-chloro-5-methyl-phenoxy)phenyl]piperazin-4-ium Formula: C17H20ClN2O+ MolecularWeight: 303.8065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC2=CC=C(C=C2)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC2=CC=C(C=C2)N3CC[NH2+]CC3

InChI

InChI=1S/C17H19ClN2O/c1-13-2-7-16(18)17(12-13)21-15-5-3-14(4-6-15)20-10-8-19-9-11-20/h2-7,12,19H,8-11H2,1H3/p+1