(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 6-chloranyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 6-chloranyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 6-chloro-4-oxo-chromene-2-carboxylate CAS Name: 6-chloro-4-oxo-1-benzopyran-2-carboxylic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 6-chloro-4-oxochromene-2-carboxylate Traditional Name: 6-chloro-4-keto-chromene-2-carboxylic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C18H10ClNO5S MolecularWeight: 387.7937

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC(=NO2)COC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1=CSC(=C1)C2=CC(=NO2)COC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C18H10ClNO5S/c19-10-3-4-14-12(6-10)13(21)8-16(24-14)18(22)23-9-11-7-15(25-20-11)17-2-1-5-26-17/h1-8H,9H2