4-[(2-bromanyl-4,6-dimethyl-phenoxy)methyl]-2H-thiopyrano[3,2-c]chromen-5-one

Systemtic Name: 4-[(2-bromanyl-4,6-dimethyl-phenoxy)methyl]-2H-thiopyrano[3,2-c]chromen-5-one Openeye Name: 4-[(2-bromo-4,6-dimethyl-phenoxy)methyl]-2H-thiopyrano[3,2-c]chromen-5-one CAS Name: 4-[(2-bromo-4,6-dimethylphenoxy)methyl]-2H-thiopyrano[3,2-c][1]benzopyran-5-one IUPAC Name: 4-[(2-bromo-4,6-dimethylphenoxy)methyl]-2H-thiopyrano[3,2-c]chromen-5-one Traditional Name: 4-[(2-bromo-4,6-dimethyl-phenoxy)methyl]-2H-thiopyrano[3,2-c]chromen-5-one Formula: C21H17BrO3S MolecularWeight: 429.32688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC2=CCSC3=C2C(=O)OC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC2=CCSC3=C2C(=O)OC4=CC=CC=C43)C

InChI

InChI=1S/C21H17BrO3S/c1-12-9-13(2)19(16(22)10-12)24-11-14-7-8-26-20-15-5-3-4-6-17(15)25-21(23)18(14)20/h3-7,9-10H,8,11H2,1-2H3