4,4-dimethyl-6-naphthalen-2-yl-7,8-dihydro-6H-[1,2,3]oxadiazolo[4,3-c][1,4]oxazepin-9-ium-3-olate

Systemtic Name: 4,4-dimethyl-6-naphthalen-2-yl-7,8-dihydro-6H-[1,2,3]oxadiazolo[4,3-c][1,4]oxazepin-9-ium-3-olate Openeye Name: 4,4-dimethyl-6-(2-naphthyl)-7,8-dihydro-6H-oxadiazolo[4,3-c][1,4]oxazepin-9-ium-3-olate CAS Name: 4,4-dimethyl-6-(2-naphthalenyl)-7,8-dihydro-6H-oxadiazolo[4,3-c][1,4]oxazepin-9-ium-3-olate IUPAC Name: 4,4-dimethyl-6-naphthalen-2-yl-7,8-dihydro-6H-oxadiazolo[4,3-c][1,4]oxazepin-9-ium-3-olate Traditional Name: 4,4-dimethyl-6-(2-naphthyl)-7,8-dihydro-6H-oxadiazolo[4,3-c][1,4]oxazepin-9-ium-3-olate Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(ON=[N+]2CCC(O1)C3=CC4=CC=CC=C4C=C3)[O-])C

Isomeric SMILES

CC1(C2=C(ON=[N+]2CCC(O1)C3=CC4=CC=CC=C4C=C3)[O-])C

InChI

InChI=1S/C18H18N2O3/c1-18(2)16-17(21)23-19-20(16)10-9-15(22-18)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11,15H,9-10H2,1-2H3