4-(3,4-dimethoxyphenyl)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,2-oxazol-5-amine

Systemtic Name: 4-(3,4-dimethoxyphenyl)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,2-oxazol-5-amine Openeye Name: 4-(3,4-dimethoxyphenyl)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]isoxazol-5-amine CAS Name: 4-(3,4-dimethoxyphenyl)-3-[(4-methyl-1-piperidin-1-iumyl)methyl]-5-isoxazolamine IUPAC Name: 4-(3,4-dimethoxyphenyl)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,2-oxazol-5-amine Traditional Name: [4-(3,4-dimethoxyphenyl)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]isoxazol-5-yl]amine Formula: C18H26N3O3+ MolecularWeight: 332.41734

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=NOC(=C2C3=CC(=C(C=C3)OC)OC)N

Isomeric SMILES

CC1CC[NH+](CC1)CC2=NOC(=C2C3=CC(=C(C=C3)OC)OC)N

InChI

InChI=1S/C18H25N3O3/c1-12-6-8-21(9-7-12)11-14-17(18(19)24-20-14)13-4-5-15(22-2)16(10-13)23-3/h4-5,10,12H,6-9,11,19H2,1-3H3/p+1