3-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-indol-3-yl]methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-indol-3-yl]methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-indol-3-yl]methylammonio]propyl-diethyl-ammonium CAS Name: 3-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-3-indolyl]methylammonio]propyl-diethylammonium IUPAC Name: 3-[[1-[(2,4-dichlorophenyl)methyl]-2-methylindol-3-yl]methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[[1-(2,4-dichlorobenzyl)-2-methyl-indol-3-yl]methylammonio]propyl-diethyl-ammonium Formula: C24H33Cl2N3+2 MolecularWeight: 434.44492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC1=C(N(C2=CC=CC=C21)CC3=C(C=C(C=C3)Cl)Cl)C

Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC1=C(N(C2=CC=CC=C21)CC3=C(C=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C24H31Cl2N3/c1-4-28(5-2)14-8-13-27-16-22-18(3)29(24-10-7-6-9-21(22)24)17-19-11-12-20(25)15-23(19)26/h6-7,9-12,15,27H,4-5,8,13-14,16-17H2,1-3H3/p+2