2-adamantyl-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-indol-3-yl]methyl]azanium

Systemtic Name: 2-adamantyl-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-indol-3-yl]methyl]azanium Openeye Name: 2-adamantyl-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-indol-3-yl]methyl]ammonium CAS Name: 2-adamantyl-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-3-indolyl]methyl]ammonium IUPAC Name: 2-adamantyl-[[1-[(2,4-dichlorophenyl)methyl]-2-methylindol-3-yl]methyl]azanium Traditional Name: 2-adamantyl-[[1-(2,4-dichlorobenzyl)-2-methyl-indol-3-yl]methyl]ammonium Formula: C27H31Cl2N2+ MolecularWeight: 454.45444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC3=C(C=C(C=C3)Cl)Cl)C[NH2+]C4C5CC6CC(C5)CC4C6

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=C(C=C(C=C3)Cl)Cl)C[NH2+]C4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C27H30Cl2N2/c1-16-24(14-30-27-20-9-17-8-18(11-20)12-21(27)10-17)23-4-2-3-5-26(23)31(16)15-19-6-7-22(28)13-25(19)29/h2-7,13,17-18,20-21,27,30H,8-12,14-15H2,1H3/p+1