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

Systemtic Name: 3-[(3S)-3-methyl-1-oxidanylidene-2H-benzo[f]chromen-3-yl]propanoate Openeye Name: 3-[(3S)-3-methyl-1-oxo-2H-benzo[f]chromen-3-yl]propanoate CAS Name: 3-[(3S)-3-methyl-1-oxo-2H-benzo[f][1]benzopyran-3-yl]propanoate IUPAC Name: 3-[(3S)-3-methyl-1-oxo-2H-benzo[f]chromen-3-yl]propanoate Traditional Name: 3-[(3S)-1-keto-3-methyl-2H-benzo[f]chromen-3-yl]propionate Formula: C17H15O4- MolecularWeight: 283.2986

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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)/p-1/t17-/m0/s1