3-[2-(phenylmethyl)-4H-chromen-6-yl]propanoic acid

Systemtic Name: 3-[2-(phenylmethyl)-4H-chromen-6-yl]propanoic acid Openeye Name: 3-(2-benzyl-4H-chromen-6-yl)propanoic acid CAS Name: 3-[2-(phenylmethyl)-4H-1-benzopyran-6-yl]propanoic acid IUPAC Name: 3-(2-benzyl-4H-chromen-6-yl)propanoic acid Traditional Name: 3-(2-benzyl-4H-chromen-6-yl)propionic acid Formula: C19H18O3 MolecularWeight: 294.34442

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(OC2=C1C=C(C=C2)CCC(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1C=C(OC2=C1C=C(C=C2)CCC(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C19H18O3/c20-19(21)11-7-15-6-10-18-16(12-15)8-9-17(22-18)13-14-4-2-1-3-5-14/h1-6,9-10,12H,7-8,11,13H2,(H,20,21)