(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 2-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(3-methoxyanilino)-2-oxoethyl]thio]benzoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-(m-anisidino)ethyl]thio]benzoic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C26H21NO7S MolecularWeight: 491.51244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CSC2=CC=CC=C2C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CSC2=CC=CC=C2C(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C26H21NO7S/c1-32-19-6-4-5-17(12-19)27-24(29)15-35-23-8-3-2-7-21(23)26(31)33-14-16-11-25(30)34-22-13-18(28)9-10-20(16)22/h2-13,28H,14-15H2,1H3,(H,27,29)