4-[[4-(6-chloranyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(6-chloranyl-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[4-(6-chloro-2-oxo-chromen-3-yl)thiazol-2-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[4-(6-chloro-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[4-(6-chloro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[4-(6-chloro-2-keto-chromen-3-yl)thiazol-2-yl]amino]-4-keto-butyric acid Formula: C16H11ClN2O5S MolecularWeight: 378.78694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C=C(C(=O)O2)C3=CSC(=N3)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)C=C(C(=O)O2)C3=CSC(=N3)NC(=O)CCC(=O)O

InChI

InChI=1S/C16H11ClN2O5S/c17-9-1-2-12-8(5-9)6-10(15(23)24-12)11-7-25-16(18-11)19-13(20)3-4-14(21)22/h1-2,5-7H,3-4H2,(H,21,22)(H,18,19,20)