[2-(1-adamantylamino)-2-oxidanylidene-ethyl]-[(2,3-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl]-[(2,3-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl]-[(2,3-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: [2-(1-adamantylamino)-2-oxoethyl]-[(2,3-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl]-[(2,3-dimethoxyphenyl)methyl]-methylazanium Traditional Name: [2-(1-adamantylamino)-2-keto-ethyl]-methyl-o-veratryl-ammonium Formula: C22H33N2O3+ MolecularWeight: 373.50902

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H32N2O3/c1-24(13-18-5-4-6-19(26-2)21(18)27-3)14-20(25)23-22-10-15-7-16(11-22)9-17(8-15)12-22/h4-6,15-17H,7-14H2,1-3H3,(H,23,25)/p+1