1-[2-(4-chloranyl-2,3-dimethyl-phenoxy)ethyl]-4-ethyl-piperazine-1,4-diium

Systemtic Name: 1-[2-(4-chloranyl-2,3-dimethyl-phenoxy)ethyl]-4-ethyl-piperazine-1,4-diium Openeye Name: 1-[2-(4-chloro-2,3-dimethyl-phenoxy)ethyl]-4-ethyl-piperazine-1,4-diium CAS Name: 1-[2-(4-chloro-2,3-dimethylphenoxy)ethyl]-4-ethylpiperazine-1,4-diium IUPAC Name: 1-[2-(4-chloro-2,3-dimethylphenoxy)ethyl]-4-ethylpiperazine-1,4-diium Traditional Name: 1-[2-(4-chloro-2,3-dimethyl-phenoxy)ethyl]-4-ethyl-piperazine-1,4-diium Formula: C16H27ClN2O+2 MolecularWeight: 298.85138

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CCOC2=C(C(=C(C=C2)Cl)C)C

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CCOC2=C(C(=C(C=C2)Cl)C)C

InChI

InChI=1S/C16H25ClN2O/c1-4-18-7-9-19(10-8-18)11-12-20-16-6-5-15(17)13(2)14(16)3/h5-6H,4,7-12H2,1-3H3/p+2