[4-[[3-(furan-2-ylmethyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] 3-nitrobenzoate

Systemtic Name: [4-[[3-(furan-2-ylmethyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] 3-nitrobenzoate Openeye Name: [4-[[3-(2-furylmethyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[[3-(2-furanylmethyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[[3-(furan-2-ylmethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-methoxyphenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[[3-(2-furfuryl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] ester Formula: C23H16N2O7S2 MolecularWeight: 496.51234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CO3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CO3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H16N2O7S2/c1-30-19-10-14(11-20-21(26)24(23(33)34-20)13-17-6-3-9-31-17)7-8-18(19)32-22(27)15-4-2-5-16(12-15)25(28)29/h2-12H,13H2,1H3