(E)-2-(1,3-dithian-2-ylidene)-5-(2-nitrophenyl)-1-phenyl-pent-4-ene-1,3-dione

Systemtic Name: (E)-2-(1,3-dithian-2-ylidene)-5-(2-nitrophenyl)-1-phenyl-pent-4-ene-1,3-dione Openeye Name: (E)-2-(1,3-dithian-2-ylidene)-5-(2-nitrophenyl)-1-phenyl-pent-4-ene-1,3-dione CAS Name: (E)-2-(1,3-dithian-2-ylidene)-5-(2-nitrophenyl)-1-phenyl-4-pentene-1,3-dione IUPAC Name: (E)-2-(1,3-dithian-2-ylidene)-5-(2-nitrophenyl)-1-phenylpent-4-ene-1,3-dione Traditional Name: (E)-2-(1,3-dithian-2-ylidene)-5-(2-nitrophenyl)-1-phenyl-pent-4-ene-1,3-dione Formula: C21H17NO4S2 MolecularWeight: 411.49398

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=C(C(=O)C=CC2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC=CC=C3)SC1

Isomeric SMILES

C1CSC(=C(C(=O)/C=C/C2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC=CC=C3)SC1

InChI

InChI=1S/C21H17NO4S2/c23-18(12-11-15-7-4-5-10-17(15)22(25)26)19(21-27-13-6-14-28-21)20(24)16-8-2-1-3-9-16/h1-5,7-12H,6,13-14H2/b12-11+