3-bromanyl-5,8-dimethoxy-2-[(4-methoxyphenyl)amino]-1,1-bis(oxidanylidene)thiochromen-4-one

Systemtic Name: 3-bromanyl-5,8-dimethoxy-2-[(4-methoxyphenyl)amino]-1,1-bis(oxidanylidene)thiochromen-4-one Openeye Name: 3-bromo-5,8-dimethoxy-2-(4-methoxyanilino)-1,1-dioxo-thiochromen-4-one CAS Name: 3-bromo-5,8-dimethoxy-2-(4-methoxyanilino)-1,1-dioxo-1-benzothiopyran-4-one IUPAC Name: 3-bromo-5,8-dimethoxy-2-(4-methoxyanilino)-1,1-dioxothiochromen-4-one Traditional Name: 3-bromo-1,1-diketo-5,8-dimethoxy-2-(p-anisidino)thiochromen-4-one Formula: C18H16BrNO6S MolecularWeight: 454.29174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=C(C(=O)C3=C(C=CC(=C3S2(=O)=O)OC)OC)Br

Isomeric SMILES

COC1=CC=C(C=C1)NC2=C(C(=O)C3=C(C=CC(=C3S2(=O)=O)OC)OC)Br

InChI

InChI=1S/C18H16BrNO6S/c1-24-11-6-4-10(5-7-11)20-18-15(19)16(21)14-12(25-2)8-9-13(26-3)17(14)27(18,22)23/h4-9,20H,1-3H3