3-[(2S)-6-chloranyl-2,5,7-trimethyl-4-oxidanylidene-3H-chromen-2-yl]propanoate

Systemtic Name: 3-[(2S)-6-chloranyl-2,5,7-trimethyl-4-oxidanylidene-3H-chromen-2-yl]propanoate Openeye Name: 3-[(2S)-6-chloro-2,5,7-trimethyl-4-oxo-chroman-2-yl]propanoate CAS Name: 3-[(2S)-6-chloro-2,5,7-trimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl]propanoate IUPAC Name: 3-[(2S)-6-chloro-2,5,7-trimethyl-4-oxo-3H-chromen-2-yl]propanoate Traditional Name: 3-[(2S)-6-chloro-4-keto-2,5,7-trimethyl-chroman-2-yl]propionate Formula: C15H16ClO4- MolecularWeight: 295.73814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1Cl)C)C(=O)CC(O2)(C)CCC(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C(=C1Cl)C)C(=O)C[C@](O2)(C)CCC(=O)[O-]

InChI

InChI=1S/C15H17ClO4/c1-8-6-11-13(9(2)14(8)16)10(17)7-15(3,20-11)5-4-12(18)19/h6H,4-5,7H2,1-3H3,(H,18,19)/p-1/t15-/m0/s1