4-[[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]-6-methoxy-chromen-2-ylidene]amino]benzoic acid

Systemtic Name: 4-[[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]-6-methoxy-chromen-2-ylidene]amino]benzoic acid Openeye Name: 4-[[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]-6-methoxy-chromen-2-ylidene]amino]benzoic acid CAS Name: 4-[[3-[(3-chloro-4-fluoroanilino)-oxomethyl]-6-methoxy-1-benzopyran-2-ylidene]amino]benzoic acid IUPAC Name: 4-[[3-[(3-chloro-4-fluorophenyl)carbamoyl]-6-methoxychromen-2-ylidene]amino]benzoic acid Traditional Name: 4-[[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]-6-methoxy-chromen-2-ylidene]amino]benzoic acid Formula: C24H16ClFN2O5 MolecularWeight: 466.845643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=NC3=CC=C(C=C3)C(=O)O)C(=C2)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=NC3=CC=C(C=C3)C(=O)O)C(=C2)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C24H16ClFN2O5/c1-32-17-7-9-21-14(10-17)11-18(22(29)27-16-6-8-20(26)19(25)12-16)23(33-21)28-15-4-2-13(3-5-15)24(30)31/h2-12H,1H3,(H,27,29)(H,30,31)