(3,4-dichlorophenyl)methyl-[(3S,5R)-3,5-dimethyl-1-adamantyl]azanium

Systemtic Name: (3,4-dichlorophenyl)methyl-[(3S,5R)-3,5-dimethyl-1-adamantyl]azanium Openeye Name: (3,4-dichlorophenyl)methyl-[(3S,5R)-3,5-dimethyl-1-adamantyl]ammonium CAS Name: (3,4-dichlorophenyl)methyl-[(3S,5R)-3,5-dimethyl-1-adamantyl]ammonium IUPAC Name: (3,4-dichlorophenyl)methyl-[(3S,5R)-3,5-dimethyl-1-adamantyl]azanium Traditional Name: (3,4-dichlorobenzyl)-[(3S,5R)-3,5-dimethyl-1-adamantyl]ammonium Formula: C19H26Cl2N+ MolecularWeight: 339.32244

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)[NH2+]CC4=CC(=C(C=C4)Cl)Cl)C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)[NH2+]CC4=CC(=C(C=C4)Cl)Cl)C

InChI

InChI=1S/C19H25Cl2N/c1-17-6-14-7-18(2,10-17)12-19(8-14,11-17)22-9-13-3-4-15(20)16(21)5-13/h3-5,14,22H,6-12H2,1-2H3/p+1/t14?,17-,18+,19?