2-[(3S,4R)-4-oxidanyl-3-(phenylmethyl)-3,4-dihydro-2H-chromen-6-yl]propanoic acid

Systemtic Name: 2-[(3S,4R)-4-oxidanyl-3-(phenylmethyl)-3,4-dihydro-2H-chromen-6-yl]propanoic acid Openeye Name: 2-[(3S,4R)-3-benzyl-4-hydroxy-chroman-6-yl]propanoic acid CAS Name: 2-[(3S,4R)-4-hydroxy-3-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-6-yl]propanoic acid IUPAC Name: 2-[(3S,4R)-3-benzyl-4-hydroxy-3,4-dihydro-2H-chromen-6-yl]propanoic acid Traditional Name: 2-[(3S,4R)-3-benzyl-4-hydroxy-chroman-6-yl]propionic acid Formula: C19H20O4 MolecularWeight: 312.3597

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCC(C2O)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)OC[C@@H]([C@H]2O)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H20O4/c1-12(19(21)22)14-7-8-17-16(10-14)18(20)15(11-23-17)9-13-5-3-2-4-6-13/h2-8,10,12,15,18,20H,9,11H2,1H3,(H,21,22)/t12?,15-,18+/m0/s1