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

Systemtic Name: (E)-2-(1,3-dithian-2-ylidene)-5-(4-nitrophenyl)-1-phenyl-pent-4-ene-1,3-dione Openeye Name: (E)-2-(1,3-dithian-2-ylidene)-5-(4-nitrophenyl)-1-phenyl-pent-4-ene-1,3-dione CAS Name: (E)-2-(1,3-dithian-2-ylidene)-5-(4-nitrophenyl)-1-phenyl-4-pentene-1,3-dione IUPAC Name: (E)-2-(1,3-dithian-2-ylidene)-5-(4-nitrophenyl)-1-phenylpent-4-ene-1,3-dione Traditional Name: (E)-2-(1,3-dithian-2-ylidene)-5-(4-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=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3)SC1

Isomeric SMILES

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

InChI

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