2-[1-(1-adamantyl)propan-2-yl-methyl-amino]-1-(4-chlorophenyl)ethanone hydrochloride

Systemtic Name: 2-[1-(1-adamantyl)propan-2-yl-methyl-amino]-1-(4-chlorophenyl)ethanone hydrochloride Openeye Name: 2-[[2-(1-adamantyl)-1-methyl-ethyl]-methyl-amino]-1-(4-chlorophenyl)ethanone hydrochloride CAS Name: 2-[1-(1-adamantyl)propan-2-yl-methylamino]-1-(4-chlorophenyl)ethanone hydrochloride IUPAC Name: 2-[1-(1-adamantyl)propan-2-yl-methylamino]-1-(4-chlorophenyl)ethanone hydrochloride Traditional Name: 2-[[2-(1-adamantyl)-1-methyl-ethyl]-methyl-amino]-1-(4-chlorophenyl)ethanone hydrochloride Formula: C22H31Cl2NO MolecularWeight: 396.39364

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC12CC3CC(C1)CC(C3)C2)N(C)CC(=O)C4=CC=C(C=C4)Cl.Cl

Isomeric SMILES

CC(CC12CC3CC(C1)CC(C3)C2)N(C)CC(=O)C4=CC=C(C=C4)Cl.Cl

InChI

InChI=1S/C22H30ClNO.ClH/c1-15(24(2)14-21(25)19-3-5-20(23)6-4-19)10-22-11-16-7-17(12-22)9-18(8-16)13-22;/h3-6,15-18H,7-14H2,1-2H3;1H