1-methyl-4-[(1R)-3-methyl-1-(1-phenethyl-1,2,3,4-tetrazol-5-yl)butyl]piperazine-1,4-diium

Systemtic Name: 1-methyl-4-[(1R)-3-methyl-1-(1-phenethyl-1,2,3,4-tetrazol-5-yl)butyl]piperazine-1,4-diium Openeye Name: 1-methyl-4-[(1R)-3-methyl-1-(1-phenethyltetrazol-5-yl)butyl]piperazine-1,4-diium CAS Name: 1-methyl-4-[(1R)-3-methyl-1-(1-phenethyl-5-tetrazolyl)butyl]piperazine-1,4-diium IUPAC Name: 1-methyl-4-[(1R)-3-methyl-1-(1-phenethyltetrazol-5-yl)butyl]piperazine-1,4-diium Traditional Name: 1-methyl-4-[(1R)-3-methyl-1-(1-phenethyltetrazol-5-yl)butyl]piperazine-1,4-diium Formula: C19H32N6+2 MolecularWeight: 344.49758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NN=NN1CCC2=CC=CC=C2)[NH+]3CC[NH+](CC3)C

Isomeric SMILES

CC(C)C[C@H](C1=NN=NN1CCC2=CC=CC=C2)[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C19H30N6/c1-16(2)15-18(24-13-11-23(3)12-14-24)19-20-21-22-25(19)10-9-17-7-5-4-6-8-17/h4-8,16,18H,9-15H2,1-3H3/p+2/t18-/m1/s1