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

Systemtic Name: (3E)-5,7-ditert-butyl-3-propylidene-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-5,7-ditert-butyl-3-propylidene-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-5,7-ditert-butyl-3-propylidene-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-5,7-ditert-butyl-3-propylidene-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-5,7-ditert-butyl-3-propylidene-2H-1,3-benzoxazol-3-ium Formula: C18H28NO+ MolecularWeight: 274.42102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28NO/c1-8-9-19-12-20-16-14(18(5,6)7)10-13(11-15(16)19)17(2,3)4/h9-11H,8,12H2,1-7H3/q+1/b19-9-