[3-(2-nitrophenyl)sulfanyl-2-oxidanylidene-chromen-4-yl] 3,5-dimethoxybenzoate

Systemtic Name: [3-(2-nitrophenyl)sulfanyl-2-oxidanylidene-chromen-4-yl] 3,5-dimethoxybenzoate Openeye Name: [3-(2-nitrophenyl)sulfanyl-2-oxo-chromen-4-yl] 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid [3-[(2-nitrophenyl)thio]-2-oxo-1-benzopyran-4-yl] ester IUPAC Name: [3-(2-nitrophenyl)sulfanyl-2-oxochromen-4-yl] 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid [2-keto-3-[(2-nitrophenyl)thio]chromen-4-yl] ester Formula: C24H17NO8S MolecularWeight: 479.45868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)OC2=C(C(=O)OC3=CC=CC=C32)SC4=CC=CC=C4[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)OC2=C(C(=O)OC3=CC=CC=C32)SC4=CC=CC=C4[N+](=O)[O-])OC

InChI

InChI=1S/C24H17NO8S/c1-30-15-11-14(12-16(13-15)31-2)23(26)33-21-17-7-3-5-9-19(17)32-24(27)22(21)34-20-10-6-4-8-18(20)25(28)29/h3-13H,1-2H3