(E)-6-(1,3-benzodioxol-5-yl)-1-(1H-indol-3-yl)hex-5-ene-1,2,4-trione

Systemtic Name: (E)-6-(1,3-benzodioxol-5-yl)-1-(1H-indol-3-yl)hex-5-ene-1,2,4-trione Openeye Name: (E)-6-(1,3-benzodioxol-5-yl)-1-(1H-indol-3-yl)hex-5-ene-1,2,4-trione CAS Name: (E)-6-(1,3-benzodioxol-5-yl)-1-(1H-indol-3-yl)-5-hexene-1,2,4-trione IUPAC Name: (E)-6-(1,3-benzodioxol-5-yl)-1-(1H-indol-3-yl)hex-5-ene-1,2,4-trione Traditional Name: (E)-6-(1,3-benzodioxol-5-yl)-1-(1H-indol-3-yl)hex-5-ene-1,2,4-trione Formula: C21H15NO5 MolecularWeight: 361.3475

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC(=O)CC(=O)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)CC(=O)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H15NO5/c23-14(7-5-13-6-8-19-20(9-13)27-12-26-19)10-18(24)21(25)16-11-22-17-4-2-1-3-15(16)17/h1-9,11,22H,10,12H2/b7-5+