[2-(1,2-benzoxazol-3-yl)-4-[(E)-3-fluoranylprop-2-enyl]phenyl]methanamine

Systemtic Name: [2-(1,2-benzoxazol-3-yl)-4-[(E)-3-fluoranylprop-2-enyl]phenyl]methanamine Openeye Name: [2-(1,2-benzoxazol-3-yl)-4-[(E)-3-fluoroallyl]phenyl]methanamine CAS Name: [2-(1,2-benzoxazol-3-yl)-4-[(E)-3-fluoroprop-2-enyl]phenyl]methanamine IUPAC Name: [2-(1,2-benzoxazol-3-yl)-4-[(E)-3-fluoroprop-2-enyl]phenyl]methanamine Traditional Name: [4-[(E)-3-fluoroallyl]-2-indoxazen-3-yl-benzyl]amine Formula: C17H15FN2O MolecularWeight: 282.312203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NO2)C3=C(C=CC(=C3)CC=CF)CN

Isomeric SMILES

C1=CC=C2C(=C1)C(=NO2)C3=C(C=CC(=C3)C/C=C/F)CN

InChI

InChI=1S/C17H15FN2O/c18-9-3-4-12-7-8-13(11-19)15(10-12)17-14-5-1-2-6-16(14)21-20-17/h1-3,5-10H,4,11,19H2/b9-3+