(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-(2-methoxyethyl)-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-(2-methoxyethyl)-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl-(2-methoxyethyl)-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium CAS Name: (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl-(2-methoxyethyl)-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]ammonium IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl-(2-methoxyethyl)-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium Traditional Name: (7-ethyl-2-keto-chromen-4-yl)methyl-(2-methoxyethyl)-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium Formula: C22H24N3O4S+ MolecularWeight: 426.50866

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](CCOC)CC3=NN=C(O3)C4=CC=CS4

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](CCOC)CC3=NN=C(O3)C4=CC=CS4

InChI

InChI=1S/C22H23N3O4S/c1-3-15-6-7-17-16(12-21(26)28-18(17)11-15)13-25(8-9-27-2)14-20-23-24-22(29-20)19-5-4-10-30-19/h4-7,10-12H,3,8-9,13-14H2,1-2H3/p+1