5-[[3-methoxy-4-(5-nitropyridin-2-yl)oxy-phenyl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[[3-methoxy-4-(5-nitropyridin-2-yl)oxy-phenyl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione Openeye Name: 5-[[3-methoxy-4-[(5-nitro-2-pyridyl)oxy]phenyl]methylene]-3-prop-2-ynyl-thiazolidine-2,4-dione CAS Name: 5-[[3-methoxy-4-[(5-nitro-2-pyridinyl)oxy]phenyl]methylidene]-3-prop-2-ynylthiazolidine-2,4-dione IUPAC Name: 5-[[3-methoxy-4-(5-nitropyridin-2-yl)oxyphenyl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione Traditional Name: 5-[3-methoxy-4-[(5-nitro-2-pyridyl)oxy]benzylidene]-3-propargyl-thiazolidine-2,4-quinone Formula: C19H13N3O6S MolecularWeight: 411.38802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC#C)OC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC#C)OC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O6S/c1-3-8-21-18(23)16(29-19(21)24)10-12-4-6-14(15(9-12)27-2)28-17-7-5-13(11-20-17)22(25)26/h1,4-7,9-11H,8H2,2H3