(E)-3-azanyl-3-(1,3-benzodioxol-5-ylamino)-1-(4-fluorophenyl)prop-2-en-1-one

Systemtic Name: (E)-3-azanyl-3-(1,3-benzodioxol-5-ylamino)-1-(4-fluorophenyl)prop-2-en-1-one Openeye Name: (E)-3-amino-3-(1,3-benzodioxol-5-ylamino)-1-(4-fluorophenyl)prop-2-en-1-one CAS Name: (E)-3-amino-3-(1,3-benzodioxol-5-ylamino)-1-(4-fluorophenyl)-2-propen-1-one IUPAC Name: (E)-3-amino-3-(1,3-benzodioxol-5-ylamino)-1-(4-fluorophenyl)prop-2-en-1-one Traditional Name: (E)-3-amino-3-(1,3-benzodioxol-5-ylamino)-1-(4-fluorophenyl)prop-2-en-1-one Formula: C16H13FN2O3 MolecularWeight: 300.284423

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=CC(=O)C3=CC=C(C=C3)F)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N/C(=C/C(=O)C3=CC=C(C=C3)F)/N

InChI

InChI=1S/C16H13FN2O3/c17-11-3-1-10(2-4-11)13(20)8-16(18)19-12-5-6-14-15(7-12)22-9-21-14/h1-8,19H,9,18H2/b16-8+