(3E)-3-(2-methylpropylidene)-7-propan-2-yl-2H-1,3-benzoxazol-3-ium

Systemtic Name: (3E)-3-(2-methylpropylidene)-7-propan-2-yl-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-7-isopropyl-3-(2-methylpropylidene)-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-3-(2-methylpropylidene)-7-propan-2-yl-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-3-(2-methylpropylidene)-7-propan-2-yl-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-7-isopropyl-3-(2-methylpropylidene)-2H-1,3-benzoxazol-3-ium Formula: C14H20NO+ MolecularWeight: 218.3147

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20NO/c1-10(2)8-15-9-16-14-12(11(3)4)6-5-7-13(14)15/h5-8,10-11H,9H2,1-4H3/q+1/b15-8-