4-bromanyl-2-[[4-[(4-ethylphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]phenol

Systemtic Name: 4-bromanyl-2-[[4-[(4-ethylphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]phenol Openeye Name: 4-bromo-2-[[4-[(4-ethylphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]phenol CAS Name: 4-bromo-2-[[4-[(4-ethylphenyl)methyl]-1-piperazine-1,4-diiumyl]methyl]phenol IUPAC Name: 4-bromo-2-[[4-[(4-ethylphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]phenol Traditional Name: 4-bromo-2-[[4-(4-ethylbenzyl)piperazine-1,4-diium-1-yl]methyl]phenol Formula: C20H27BrN2O+2 MolecularWeight: 391.34518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25BrN2O/c1-2-16-3-5-17(6-4-16)14-22-9-11-23(12-10-22)15-18-13-19(21)7-8-20(18)24/h3-8,13,24H,2,9-12,14-15H2,1H3/p+2