1-ethyl-4-[(2R)-4-(4-methoxyphenyl)butan-2-yl]piperazine-1,4-diium

Systemtic Name: 1-ethyl-4-[(2R)-4-(4-methoxyphenyl)butan-2-yl]piperazine-1,4-diium Openeye Name: 1-ethyl-4-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]piperazine-1,4-diium CAS Name: 1-ethyl-4-[(2R)-4-(4-methoxyphenyl)butan-2-yl]piperazine-1,4-diium IUPAC Name: 1-ethyl-4-[(2R)-4-(4-methoxyphenyl)butan-2-yl]piperazine-1,4-diium Traditional Name: 1-ethyl-4-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]piperazine-1,4-diium Formula: C17H30N2O+2 MolecularWeight: 278.4329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)C(C)CCC2=CC=C(C=C2)OC

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)[C@H](C)CCC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H28N2O/c1-4-18-11-13-19(14-12-18)15(2)5-6-16-7-9-17(20-3)10-8-16/h7-10,15H,4-6,11-14H2,1-3H3/p+2/t15-/m1/s1