1-adamantylmethyl-[[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-methyl-azanium

Systemtic Name: 1-adamantylmethyl-[[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-methyl-azanium Openeye Name: 1-adamantylmethyl-[[2-(3,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-methyl-ammonium CAS Name: 1-adamantylmethyl-[[2-(3,4-dimethoxyphenyl)-5-methyl-4-oxazolyl]methyl]-methylammonium IUPAC Name: 1-adamantylmethyl-[[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-methylazanium Traditional Name: 1-adamantylmethyl-[[2-(3,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-methyl-ammonium Formula: C25H35N2O3+ MolecularWeight: 411.557

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=C(C=C2)OC)OC)C[NH+](C)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=C(C=C2)OC)OC)C[NH+](C)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H34N2O3/c1-16-21(26-24(30-16)20-5-6-22(28-3)23(10-20)29-4)14-27(2)15-25-11-17-7-18(12-25)9-19(8-17)13-25/h5-6,10,17-19H,7-9,11-15H2,1-4H3/p+1