(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]benzoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]benzoic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C28H21NO6S MolecularWeight: 499.53444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=CC=CC=C4SCC(=O)NCC5=CC=CO5

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)COC(=O)C4=CC=CC=C4SCC(=O)NCC5=CC=CO5

InChI

InChI=1S/C28H21NO6S/c30-25(29-15-20-7-5-13-33-20)17-36-24-10-4-3-9-22(24)28(32)34-16-19-14-26(31)35-23-12-11-18-6-1-2-8-21(18)27(19)23/h1-14H,15-17H2,(H,29,30)