1-[(2R)-4-phenylbutan-2-yl]-4-(phenylmethyl)piperazine-1,4-diium

Systemtic Name: 1-[(2R)-4-phenylbutan-2-yl]-4-(phenylmethyl)piperazine-1,4-diium Openeye Name: 1-benzyl-4-[(1R)-1-methyl-3-phenyl-propyl]piperazine-1,4-diium CAS Name: 1-[(2R)-4-phenylbutan-2-yl]-4-(phenylmethyl)piperazine-1,4-diium IUPAC Name: 1-benzyl-4-[(2R)-4-phenylbutan-2-yl]piperazine-1,4-diium Traditional Name: 1-benzyl-4-[(1R)-1-methyl-3-phenyl-propyl]piperazine-1,4-diium Formula: C21H30N2+2 MolecularWeight: 310.4763

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H28N2/c1-19(12-13-20-8-4-2-5-9-20)23-16-14-22(15-17-23)18-21-10-6-3-7-11-21/h2-11,19H,12-18H2,1H3/p+2/t19-/m1/s1