2-adamantyl-[[1-[(2-chlorophenyl)methyl]-2-methyl-indol-3-yl]methyl]azanium

Systemtic Name: 2-adamantyl-[[1-[(2-chlorophenyl)methyl]-2-methyl-indol-3-yl]methyl]azanium Openeye Name: 2-adamantyl-[[1-[(2-chlorophenyl)methyl]-2-methyl-indol-3-yl]methyl]ammonium CAS Name: 2-adamantyl-[[1-[(2-chlorophenyl)methyl]-2-methyl-3-indolyl]methyl]ammonium IUPAC Name: 2-adamantyl-[[1-[(2-chlorophenyl)methyl]-2-methylindol-3-yl]methyl]azanium Traditional Name: 2-adamantyl-[[1-(2-chlorobenzyl)-2-methyl-indol-3-yl]methyl]ammonium Formula: C27H32ClN2+ MolecularWeight: 420.00938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3Cl)C[NH2+]C4C5CC6CC(C5)CC4C6

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3Cl)C[NH2+]C4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C27H31ClN2/c1-17-24(15-29-27-21-11-18-10-19(13-21)14-22(27)12-18)23-7-3-5-9-26(23)30(17)16-20-6-2-4-8-25(20)28/h2-9,18-19,21-22,27,29H,10-16H2,1H3/p+1