(3E)-5,7-ditert-butyl-3-(2,2-dimethylpropylidene)-2H-1,3-benzoxazol-3-ium

Systemtic Name: (3E)-5,7-ditert-butyl-3-(2,2-dimethylpropylidene)-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-5,7-ditert-butyl-3-(2,2-dimethylpropylidene)-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-5,7-ditert-butyl-3-(2,2-dimethylpropylidene)-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-5,7-ditert-butyl-3-(2,2-dimethylpropylidene)-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-5,7-ditert-butyl-3-neopentylidene-2H-1,3-benzoxazol-3-ium Formula: C20H32NO+ MolecularWeight: 302.47418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C=[N+]1COC2=C(C=C(C=C21)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C)(C)/C=[N+]\1/COC2=C(C=C(C=C21)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C20H32NO/c1-18(2,3)12-21-13-22-17-15(20(7,8)9)10-14(11-16(17)21)19(4,5)6/h10-12H,13H2,1-9H3/q+1/b21-12-