(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C20H15NO6S MolecularWeight: 397.4012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)CSC3=NC4=CC=CC=C4O3)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)CSC3=NC4=CC=CC=C4O3)O

InChI

InChI=1S/C20H15NO6S/c1-11-15(22)7-6-13-12(8-17(23)27-19(11)13)9-25-18(24)10-28-20-21-14-4-2-3-5-16(14)26-20/h2-8,22H,9-10H2,1H3