1-[2-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[2-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[2-(4-chloro-2-isopropyl-5-methyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)ethyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)ethyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[2-(4-chloro-2-isopropyl-5-methyl-phenoxy)ethyl]-4-methyl-piperazine-1,4-diium Formula: C17H29ClN2O+2 MolecularWeight: 312.87796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C(C)C)OCC[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C(C)C)OCC[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C17H27ClN2O/c1-13(2)15-12-16(18)14(3)11-17(15)21-10-9-20-7-5-19(4)6-8-20/h11-13H,5-10H2,1-4H3/p+2