3-[(3S)-3-methyl-1-oxidanylidene-2H-benzo[f]chromen-3-yl]propanoic acid

Systemtic Name: 3-[(3S)-3-methyl-1-oxidanylidene-2H-benzo[f]chromen-3-yl]propanoic acid Openeye Name: 3-[(3S)-3-methyl-1-oxo-2H-benzo[f]chromen-3-yl]propanoic acid CAS Name: 3-[(3S)-3-methyl-1-oxo-2H-benzo[f][1]benzopyran-3-yl]propanoic acid IUPAC Name: 3-[(3S)-3-methyl-1-oxo-2H-benzo[f]chromen-3-yl]propanoic acid Traditional Name: 3-[(3S)-1-keto-3-methyl-2H-benzo[f]chromen-3-yl]propionic acid Formula: C17H16O4 MolecularWeight: 284.30654

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(O1)C=CC3=CC=CC=C32)CCC(=O)O

Isomeric SMILES

C[C@@]1(CC(=O)C2=C(O1)C=CC3=CC=CC=C32)CCC(=O)O

InChI

InChI=1S/C17H16O4/c1-17(9-8-15(19)20)10-13(18)16-12-5-3-2-4-11(12)6-7-14(16)21-17/h2-7H,8-10H2,1H3,(H,19,20)/t17-/m0/s1