(4-methyl-2-oxidanylidene-chromen-7-yl) (3S)-3-phenylbutanoate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) (3S)-3-phenylbutanoate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) (3S)-3-phenylbutanoate CAS Name: (3S)-3-phenylbutanoic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) (3S)-3-phenylbutanoate Traditional Name: (3S)-3-phenylbutyric acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C20H18O4 MolecularWeight: 322.35452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)CC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C20H18O4/c1-13(15-6-4-3-5-7-15)10-19(21)23-16-8-9-17-14(2)11-20(22)24-18(17)12-16/h3-9,11-13H,10H2,1-2H3/t13-/m0/s1