3-[4-oxidanylidene-2-(phenylmethyl)-2,3-dihydrochromen-7-yl]propanoic acid

Systemtic Name: 3-[4-oxidanylidene-2-(phenylmethyl)-2,3-dihydrochromen-7-yl]propanoic acid Openeye Name: 3-(2-benzyl-4-oxo-chroman-7-yl)propanoic acid CAS Name: 3-[4-oxo-2-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-7-yl]propanoic acid IUPAC Name: 3-(2-benzyl-4-oxo-2,3-dihydrochromen-7-yl)propanoic acid Traditional Name: 3-(2-benzyl-4-keto-chroman-7-yl)propionic acid Formula: C19H18O4 MolecularWeight: 310.34382

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(C1=O)C=CC(=C2)CCC(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1C(OC2=C(C1=O)C=CC(=C2)CCC(=O)O)CC3=CC=CC=C3

InChI

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