(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 3-acetamido-3-thiophen-2-yl-propanoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 3-acetamido-3-thiophen-2-yl-propanoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 3-acetamido-3-(2-thienyl)propanoate CAS Name: 3-acetamido-3-thiophen-2-ylpropanoic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 3-acetamido-3-thiophen-2-ylpropanoate Traditional Name: 3-acetamido-3-(2-thienyl)propionic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C19H16BrNO5S MolecularWeight: 450.30304

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)Br)C3=CC=CS3

Isomeric SMILES

CC(=O)NC(CC(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)Br)C3=CC=CS3

InChI

InChI=1S/C19H16BrNO5S/c1-11(22)21-15(17-3-2-6-27-17)9-18(23)25-10-12-7-19(24)26-16-8-13(20)4-5-14(12)16/h2-8,15H,9-10H2,1H3,(H,21,22)