bis(2-chloroethyl)-methyl-[(4-nitrophenyl)methyl]azanium bromide

Systemtic Name: bis(2-chloroethyl)-methyl-[(4-nitrophenyl)methyl]azanium bromide Openeye Name: bis(2-chloroethyl)-methyl-[(4-nitrophenyl)methyl]ammonium bromide CAS Name: bis(2-chloroethyl)-methyl-[(4-nitrophenyl)methyl]ammonium bromide IUPAC Name: bis(2-chloroethyl)-methyl-[(4-nitrophenyl)methyl]azanium bromide Traditional Name: bis(2-chloroethyl)-methyl-(4-nitrobenzyl)ammonium bromide Formula: C12H17BrCl2N2O2 MolecularWeight: 372.08558

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CCCl)(CCCl)CC1=CC=C(C=C1)[N+](=O)[O-].[Br-]

Isomeric SMILES

C[N+](CCCl)(CCCl)CC1=CC=C(C=C1)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C12H17Cl2N2O2.BrH/c1-16(8-6-13,9-7-14)10-11-2-4-12(5-3-11)15(17)18;/h2-5H,6-10H2,1H3;1H/q+1;/p-1