2-[(E)-2-ethoxybut-1-enyl]-3-ethyl-5-phenyl-1,3-benzoxazol-3-ium

Systemtic Name: 2-[(E)-2-ethoxybut-1-enyl]-3-ethyl-5-phenyl-1,3-benzoxazol-3-ium Openeye Name: 2-[(E)-2-ethoxybut-1-enyl]-3-ethyl-5-phenyl-1,3-benzoxazol-3-ium CAS Name: 2-[(E)-2-ethoxybut-1-enyl]-3-ethyl-5-phenyl-1,3-benzoxazol-3-ium IUPAC Name: 2-[(E)-2-ethoxybut-1-enyl]-3-ethyl-5-phenyl-1,3-benzoxazol-3-ium Traditional Name: 2-[(E)-2-ethoxybut-1-enyl]-3-ethyl-5-phenyl-1,3-benzoxazol-3-ium Formula: C21H24NO2+ MolecularWeight: 322.42076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CC)OCC

Isomeric SMILES

CC/C(=C\C1=[N+](C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CC)/OCC

InChI

InChI=1S/C21H24NO2/c1-4-18(23-6-3)15-21-22(5-2)19-14-17(12-13-20(19)24-21)16-10-8-7-9-11-16/h7-15H,4-6H2,1-3H3/q+1/b18-15+