2-(2,3-dimethoxyphenyl)-5-methyl-4-[(4-phenethylpiperidin-1-ium-1-yl)methyl]-1,3-oxazole

Systemtic Name: 2-(2,3-dimethoxyphenyl)-5-methyl-4-[(4-phenethylpiperidin-1-ium-1-yl)methyl]-1,3-oxazole Openeye Name: 2-(2,3-dimethoxyphenyl)-5-methyl-4-[(4-phenethylpiperidin-1-ium-1-yl)methyl]oxazole CAS Name: 2-(2,3-dimethoxyphenyl)-5-methyl-4-[(4-phenethyl-1-piperidin-1-iumyl)methyl]oxazole IUPAC Name: 2-(2,3-dimethoxyphenyl)-5-methyl-4-[(4-phenethylpiperidin-1-ium-1-yl)methyl]-1,3-oxazole Traditional Name: 2-(2,3-dimethoxyphenyl)-5-methyl-4-[(4-phenethylpiperidin-1-ium-1-yl)methyl]oxazole Formula: C26H33N2O3+ MolecularWeight: 421.55182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=C(C(=CC=C2)OC)OC)C[NH+]3CCC(CC3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=C(C(=CC=C2)OC)OC)C[NH+]3CCC(CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C26H32N2O3/c1-19-23(27-26(31-19)22-10-7-11-24(29-2)25(22)30-3)18-28-16-14-21(15-17-28)13-12-20-8-5-4-6-9-20/h4-11,21H,12-18H2,1-3H3/p+1