(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-propyl-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]ammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium Traditional Name: (2-keto-7,8-dimethyl-chromen-4-yl)methyl-propyl-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium Formula: C22H24N3O3S+ MolecularWeight: 410.50926

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CC(=O)OC2=C1C=CC(=C2C)C)CC3=NN=C(O3)C4=CC=CS4

Isomeric SMILES

CCC[NH+](CC1=CC(=O)OC2=C1C=CC(=C2C)C)CC3=NN=C(O3)C4=CC=CS4

InChI

InChI=1S/C22H23N3O3S/c1-4-9-25(13-19-23-24-22(27-19)18-6-5-10-29-18)12-16-11-20(26)28-21-15(3)14(2)7-8-17(16)21/h5-8,10-11H,4,9,12-13H2,1-3H3/p+1