8-[4-(2-methylpropoxy)butoxy]-3-(2H-1,2,3,4-tetrazol-5-yl)chromen-2-one

Systemtic Name: 8-[4-(2-methylpropoxy)butoxy]-3-(2H-1,2,3,4-tetrazol-5-yl)chromen-2-one Openeye Name: 8-(4-isobutoxybutoxy)-3-(2H-tetrazol-5-yl)chromen-2-one CAS Name: 8-[4-(2-methylpropoxy)butoxy]-3-(2H-tetrazol-5-yl)-1-benzopyran-2-one IUPAC Name: 8-[4-(2-methylpropoxy)butoxy]-3-(2H-tetrazol-5-yl)chromen-2-one Traditional Name: 8-(4-isobutoxybutoxy)-3-(2H-tetrazol-5-yl)coumarin Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCCCOC1=CC=CC2=C1OC(=O)C(=C2)C3=NNN=N3

Isomeric SMILES

CC(C)COCCCCOC1=CC=CC2=C1OC(=O)C(=C2)C3=NNN=N3

InChI

InChI=1S/C18H22N4O4/c1-12(2)11-24-8-3-4-9-25-15-7-5-6-13-10-14(17-19-21-22-20-17)18(23)26-16(13)15/h5-7,10,12H,3-4,8-9,11H2,1-2H3,(H,19,20,21,22)