1-methyl-4-[4-(3-propoxyphenoxy)butyl]piperazine-1,4-diium

Systemtic Name: 1-methyl-4-[4-(3-propoxyphenoxy)butyl]piperazine-1,4-diium Openeye Name: 1-methyl-4-[4-(3-propoxyphenoxy)butyl]piperazine-1,4-diium CAS Name: 1-methyl-4-[4-(3-propoxyphenoxy)butyl]piperazine-1,4-diium IUPAC Name: 1-methyl-4-[4-(3-propoxyphenoxy)butyl]piperazine-1,4-diium Traditional Name: 1-methyl-4-[4-(3-propoxyphenoxy)butyl]piperazine-1,4-diium Formula: C18H32N2O2+2 MolecularWeight: 308.45888

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=CC=C1)OCCCC[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CCCOC1=CC(=CC=C1)OCCCC[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C18H30N2O2/c1-3-14-21-17-7-6-8-18(16-17)22-15-5-4-9-20-12-10-19(2)11-13-20/h6-8,16H,3-5,9-15H2,1-2H3/p+2