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

Systemtic Name: 1-adamantyl-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-indol-3-yl]methyl]azanium Openeye Name: 1-adamantyl-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-indol-3-yl]methyl]ammonium CAS Name: 1-adamantyl-[[1-[(2,4-dichlorophenyl)methyl]-2-methyl-3-indolyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[1-[(2,4-dichlorophenyl)methyl]-2-methylindol-3-yl]methyl]azanium Traditional Name: 1-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+]C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=C(C=C(C=C3)Cl)Cl)C[NH2+]C45CC6CC(C4)CC(C6)C5

InChI

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