3-[4-oxidanyl-3-(phenylmethyl)-2H-chromen-7-yl]propanoic acid

Systemtic Name: 3-[4-oxidanyl-3-(phenylmethyl)-2H-chromen-7-yl]propanoic acid Openeye Name: 3-(3-benzyl-4-hydroxy-2H-chromen-7-yl)propanoic acid CAS Name: 3-[4-hydroxy-3-(phenylmethyl)-2H-1-benzopyran-7-yl]propanoic acid IUPAC Name: 3-(3-benzyl-4-hydroxy-2H-chromen-7-yl)propanoic acid Traditional Name: 3-(3-benzyl-4-hydroxy-2H-chromen-7-yl)propionic acid Formula: C19H18O4 MolecularWeight: 310.34382

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(C2=C(O1)C=C(C=C2)CCC(=O)O)O)CC3=CC=CC=C3

Isomeric SMILES

C1C(=C(C2=C(O1)C=C(C=C2)CCC(=O)O)O)CC3=CC=CC=C3

InChI

InChI=1S/C19H18O4/c20-18(21)9-7-14-6-8-16-17(11-14)23-12-15(19(16)22)10-13-4-2-1-3-5-13/h1-6,8,11,22H,7,9-10,12H2,(H,20,21)