2-[[2-(1,3-benzodioxol-5-yl)-6-methyl-chromen-4-ylidene]amino]propanoic acid

Systemtic Name: 2-[[2-(1,3-benzodioxol-5-yl)-6-methyl-chromen-4-ylidene]amino]propanoic acid Openeye Name: 2-[[2-(1,3-benzodioxol-5-yl)-6-methyl-chromen-4-ylidene]amino]propanoic acid CAS Name: 2-[[2-(1,3-benzodioxol-5-yl)-6-methyl-1-benzopyran-4-ylidene]amino]propanoic acid IUPAC Name: 2-[[2-(1,3-benzodioxol-5-yl)-6-methylchromen-4-ylidene]amino]propanoic acid Traditional Name: 2-[[2-(1,3-benzodioxol-5-yl)-6-methyl-chromen-4-ylidene]amino]propionic acid Formula: C20H17NO5 MolecularWeight: 351.35268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=CC2=NC(C)C(=O)O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=CC2=NC(C)C(=O)O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H17NO5/c1-11-3-5-16-14(7-11)15(21-12(2)20(22)23)9-18(26-16)13-4-6-17-19(8-13)25-10-24-17/h3-9,12H,10H2,1-2H3,(H,22,23)