[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-prop-2-enyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-prop-2-enyl-(thiophen-2-ylmethyl)azanium Openeye Name: allyl-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-(2-thienylmethyl)ammonium CAS Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-prop-2-enyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-prop-2-enyl-(thiophen-2-ylmethyl)azanium Traditional Name: allyl-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-(2-thenyl)ammonium Formula: C19H22N3O3S+ MolecularWeight: 372.46128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)C[NH+](CC=C)CC3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)C[NH+](CC=C)CC3=CC=CS3)OC

InChI

InChI=1S/C19H21N3O3S/c1-4-9-22(12-15-6-5-10-26-15)13-18-20-19(21-25-18)14-7-8-16(23-2)17(11-14)24-3/h4-8,10-11H,1,9,12-13H2,2-3H3/p+1