3-[(4-chloranyl-3-methanoyl-2-oxidanylidene-chromen-7-yl)-ethyl-amino]propanoic acid

Systemtic Name: 3-[(4-chloranyl-3-methanoyl-2-oxidanylidene-chromen-7-yl)-ethyl-amino]propanoic acid Openeye Name: 3-[(4-chloro-3-formyl-2-oxo-chromen-7-yl)-ethyl-amino]propanoic acid CAS Name: 3-[(4-chloro-3-formyl-2-oxo-1-benzopyran-7-yl)-ethylamino]propanoic acid IUPAC Name: 3-[(4-chloro-3-formyl-2-oxochromen-7-yl)-ethylamino]propanoic acid Traditional Name: 3-[(4-chloro-3-formyl-2-keto-chromen-7-yl)-ethyl-amino]propionic acid Formula: C15H14ClNO5 MolecularWeight: 323.72836

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(=O)O)C1=CC2=C(C=C1)C(=C(C(=O)O2)C=O)Cl

Isomeric SMILES

CCN(CCC(=O)O)C1=CC2=C(C=C1)C(=C(C(=O)O2)C=O)Cl

InChI

InChI=1S/C15H14ClNO5/c1-2-17(6-5-13(19)20)9-3-4-10-12(7-9)22-15(21)11(8-18)14(10)16/h3-4,7-8H,2,5-6H2,1H3,(H,19,20)