(E)-3-(1,3-benzodioxol-5-yl)-1-(10H-phenothiazin-2-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(10H-phenothiazin-2-yl)prop-2-en-1-one Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(10H-phenothiazin-2-yl)prop-2-en-1-one CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(10H-phenothiazin-2-yl)-2-propen-1-one IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(10H-phenothiazin-2-yl)prop-2-en-1-one Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(10H-phenothiazin-2-yl)prop-2-en-1-one Formula: C22H15NO3S MolecularWeight: 373.4244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC(=O)C3=CC4=C(C=C3)SC5=CC=CC=C5N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)C3=CC4=C(C=C3)SC5=CC=CC=C5N4

InChI

InChI=1S/C22H15NO3S/c24-18(8-5-14-6-9-19-20(11-14)26-13-25-19)15-7-10-22-17(12-15)23-16-3-1-2-4-21(16)27-22/h1-12,23H,13H2/b8-5+