4-[[(E)-[(2S)-6-chloranyl-2-ethoxy-4-oxidanylidene-chromen-3-ylidene]methyl]amino]benzoic acid

Systemtic Name: 4-[[(E)-[(2S)-6-chloranyl-2-ethoxy-4-oxidanylidene-chromen-3-ylidene]methyl]amino]benzoic acid Openeye Name: 4-[[(E)-[(2S)-6-chloro-2-ethoxy-4-oxo-chroman-3-ylidene]methyl]amino]benzoic acid CAS Name: 4-[[(E)-[(2S)-6-chloro-2-ethoxy-4-oxo-3,4-dihydro-2H-1-benzopyran-3-ylidene]methyl]amino]benzoic acid IUPAC Name: 4-[[(E)-[(2S)-6-chloro-2-ethoxy-4-oxochromen-3-ylidene]methyl]amino]benzoic acid Traditional Name: 4-[[(E)-[(2S)-6-chloro-2-ethoxy-4-keto-chroman-3-ylidene]methyl]amino]benzoic acid Formula: C19H16ClNO5 MolecularWeight: 373.78704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(=CNC2=CC=C(C=C2)C(=O)O)C(=O)C3=C(O1)C=CC(=C3)Cl

Isomeric SMILES

CCO[C@@H]1/C(=C\NC2=CC=C(C=C2)C(=O)O)/C(=O)C3=C(O1)C=CC(=C3)Cl

InChI

InChI=1S/C19H16ClNO5/c1-2-25-19-15(10-21-13-6-3-11(4-7-13)18(23)24)17(22)14-9-12(20)5-8-16(14)26-19/h3-10,19,21H,2H2,1H3,(H,23,24)/b15-10-/t19-/m0/s1