1-[(1R)-3-methyl-1-(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)butyl]-4-phenyl-piperazin-1-ium

Systemtic Name: 1-[(1R)-3-methyl-1-(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)butyl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[(1R)-1-(1-isopropyltetrazol-5-yl)-3-methyl-butyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[(1R)-3-methyl-1-(1-propan-2-yl-5-tetrazolyl)butyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[(1R)-3-methyl-1-(1-propan-2-yltetrazol-5-yl)butyl]-4-phenylpiperazin-1-ium Traditional Name: 1-[(1R)-1-(1-isopropyltetrazol-5-yl)-3-methyl-butyl]-4-phenyl-piperazin-1-ium Formula: C19H31N6+ MolecularWeight: 343.48964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NN=NN1C(C)C)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C[C@H](C1=NN=NN1C(C)C)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H30N6/c1-15(2)14-18(19-20-21-22-25(19)16(3)4)24-12-10-23(11-13-24)17-8-6-5-7-9-17/h5-9,15-16,18H,10-14H2,1-4H3/p+1/t18-/m1/s1