dimethyl (E)-2-[(2-bromanyl-6-methyl-4-oxidanylidene-thiochromen-3-yl)amino]but-2-enedioate

Systemtic Name: dimethyl (E)-2-[(2-bromanyl-6-methyl-4-oxidanylidene-thiochromen-3-yl)amino]but-2-enedioate Openeye Name: dimethyl (E)-2-[(2-bromo-6-methyl-4-oxo-thiochromen-3-yl)amino]but-2-enedioate CAS Name: (E)-2-[(2-bromo-6-methyl-4-oxo-1-benzothiopyran-3-yl)amino]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-[(2-bromo-6-methyl-4-oxothiochromen-3-yl)amino]but-2-enedioate Traditional Name: (E)-2-[(2-bromo-4-keto-6-methyl-thiochromen-3-yl)amino]but-2-enedioic acid dimethyl ester Formula: C16H14BrNO5S MolecularWeight: 412.25506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=C(C2=O)NC(=CC(=O)OC)C(=O)OC)Br

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=C(C2=O)N/C(=C/C(=O)OC)/C(=O)OC)Br

InChI

InChI=1S/C16H14BrNO5S/c1-8-4-5-11-9(6-8)14(20)13(15(17)24-11)18-10(16(21)23-3)7-12(19)22-2/h4-7,18H,1-3H3/b10-7+