3-[[3,5-bis(chloranyl)-4-phenylmethoxy-phenyl]methylazaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[3,5-bis(chloranyl)-4-phenylmethoxy-phenyl]methylazaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[(4-benzyloxy-3,5-dichloro-phenyl)methylammonio]propyl-dimethyl-ammonium CAS Name: 3-[(3,5-dichloro-4-phenylmethoxyphenyl)methylammonio]propyl-dimethylammonium IUPAC Name: 3-[(3,5-dichloro-4-phenylmethoxyphenyl)methylazaniumyl]propyl-dimethylazanium Traditional Name: 3-[(4-benzoxy-3,5-dichloro-benzyl)ammonio]propyl-dimethyl-ammonium Formula: C19H26Cl2N2O+2 MolecularWeight: 369.32854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC2=CC=CC=C2)Cl

Isomeric SMILES

C[NH+](C)CCC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC2=CC=CC=C2)Cl

InChI

InChI=1S/C19H24Cl2N2O/c1-23(2)10-6-9-22-13-16-11-17(20)19(18(21)12-16)24-14-15-7-4-3-5-8-15/h3-5,7-8,11-12,22H,6,9-10,13-14H2,1-2H3/p+2