4'-butoxy-4-methyl-spiro[1,3-dioxetane-2,3'-isoindole]-1'-amine

Systemtic Name: 4'-butoxy-4-methyl-spiro[1,3-dioxetane-2,3'-isoindole]-1'-amine Openeye Name: 4'-butoxy-4-methyl-spiro[1,3-dioxetane-2,3'-isoindole]-1'-amine CAS Name: 4'-butoxy-4-methyl-1'-spiro[1,3-dioxetane-2,3'-isoindole]amine IUPAC Name: 4'-butoxy-4-methylspiro[1,3-dioxetane-2,3'-isoindole]-1'-amine Traditional Name: (4'-butoxy-4-methyl-spiro[1,3-dioxetane-2,3'-isoindole]-1'-yl)amine Formula: C14H18N2O3 MolecularWeight: 262.30432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC2=C1C3(N=C2N)OC(O3)C

Isomeric SMILES

CCCCOC1=CC=CC2=C1C3(N=C2N)OC(O3)C

InChI

InChI=1S/C14H18N2O3/c1-3-4-8-17-11-7-5-6-10-12(11)14(16-13(10)15)18-9(2)19-14/h5-7,9H,3-4,8H2,1-2H3,(H2,15,16)