[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 2-(2-oxidanylidenechromen-7-yl)oxyethanoate

Systemtic Name: [2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 2-(2-oxidanylidenechromen-7-yl)oxyethanoate Openeye Name: [2-(4-chlorophenyl)thiazol-4-yl]methyl 2-(2-oxochromen-7-yl)oxyacetate CAS Name: 2-[(2-oxo-1-benzopyran-7-yl)oxy]acetic acid [2-(4-chlorophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl 2-(2-oxochromen-7-yl)oxyacetate Traditional Name: 2-(2-ketochromen-7-yl)oxyacetic acid [2-(4-chlorophenyl)thiazol-4-yl]methyl ester Formula: C21H14ClNO5S MolecularWeight: 427.85756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC(=O)O2)OCC(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=CC2=C1C=CC(=O)O2)OCC(=O)OCC3=CSC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14ClNO5S/c22-15-5-1-14(2-6-15)21-23-16(12-29-21)10-27-20(25)11-26-17-7-3-13-4-8-19(24)28-18(13)9-17/h1-9,12H,10-11H2