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

Systemtic Name: [5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-propyl-azanium Openeye Name: [5-(2-furyl)-1,3,4-oxadiazol-2-yl]methyl-[(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl]-propyl-ammonium CAS Name: [5-(2-furanyl)-1,3,4-oxadiazol-2-yl]methyl-[(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl]-propylammonium IUPAC Name: [5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-[(7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl]-propylazanium Traditional Name: [5-(2-furyl)-1,3,4-oxadiazol-2-yl]methyl-[(7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl]-propyl-ammonium Formula: C21H22N3O5+ MolecularWeight: 396.41648

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CC(=O)OC2=C1C=CC(=C2C)O)CC3=NN=C(O3)C4=CC=CO4

Isomeric SMILES

CCC[NH+](CC1=CC(=O)OC2=C1C=CC(=C2C)O)CC3=NN=C(O3)C4=CC=CO4

InChI

InChI=1S/C21H21N3O5/c1-3-8-24(12-18-22-23-21(28-18)17-5-4-9-27-17)11-14-10-19(26)29-20-13(2)16(25)7-6-15(14)20/h4-7,9-10,25H,3,8,11-12H2,1-2H3/p+1