1-[(1R)-1-[1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrazol-5-yl]-2-methyl-propyl]-4-phenyl-piperazine-1,4-diium

Systemtic Name: 1-[(1R)-1-[1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrazol-5-yl]-2-methyl-propyl]-4-phenyl-piperazine-1,4-diium Openeye Name: 1-[(1R)-1-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]-2-methyl-propyl]-4-phenyl-piperazine-1,4-diium CAS Name: 1-[(1R)-1-[1-[(4-methoxyphenyl)methyl]-5-tetrazolyl]-2-methylpropyl]-4-phenylpiperazine-1,4-diium IUPAC Name: 1-[(1R)-1-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]-2-methylpropyl]-4-phenylpiperazine-1,4-diium Traditional Name: 1-[(1R)-2-methyl-1-(1-p-anisyltetrazol-5-yl)propyl]-4-phenyl-piperazine-1,4-diium Formula: C23H32N6O+2 MolecularWeight: 408.53978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NN=NN1CC2=CC=C(C=C2)OC)[NH+]3CC[NH+](CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)[C@H](C1=NN=NN1CC2=CC=C(C=C2)OC)[NH+]3CC[NH+](CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H30N6O/c1-18(2)22(28-15-13-27(14-16-28)20-7-5-4-6-8-20)23-24-25-26-29(23)17-19-9-11-21(30-3)12-10-19/h4-12,18,22H,13-17H2,1-3H3/p+2/t22-/m1/s1