(E)-5-(1,3-benzodioxol-5-yl)-2-(1,3-dithiepan-2-ylidene)-1-phenyl-pent-4-ene-1,3-dione

Systemtic Name: (E)-5-(1,3-benzodioxol-5-yl)-2-(1,3-dithiepan-2-ylidene)-1-phenyl-pent-4-ene-1,3-dione Openeye Name: (E)-5-(1,3-benzodioxol-5-yl)-2-(1,3-dithiepan-2-ylidene)-1-phenyl-pent-4-ene-1,3-dione CAS Name: (E)-5-(1,3-benzodioxol-5-yl)-2-(1,3-dithiepan-2-ylidene)-1-phenyl-4-pentene-1,3-dione IUPAC Name: (E)-5-(1,3-benzodioxol-5-yl)-2-(1,3-dithiepan-2-ylidene)-1-phenylpent-4-ene-1,3-dione Traditional Name: (E)-5-(1,3-benzodioxol-5-yl)-2-(1,3-dithiepan-2-ylidene)-1-phenyl-pent-4-ene-1,3-dione Formula: C23H20O4S2 MolecularWeight: 424.5325

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Descriptors Computed from Structure

Canonical SMILES:

C1CCSC(=C(C(=O)C=CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4)SC1

Isomeric SMILES

C1CCSC(=C(C(=O)/C=C/C2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4)SC1

InChI

InChI=1S/C23H20O4S2/c24-18(10-8-16-9-11-19-20(14-16)27-15-26-19)21(23-28-12-4-5-13-29-23)22(25)17-6-2-1-3-7-17/h1-3,6-11,14H,4-5,12-13,15H2/b10-8+