(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl (2S)-2-(4-cyanophenoxy)propanoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl (2S)-2-(4-cyanophenoxy)propanoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl (2S)-2-(4-cyanophenoxy)propanoate CAS Name: (2S)-2-(4-cyanophenoxy)propanoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl (2S)-2-(4-cyanophenoxy)propanoate Traditional Name: (2S)-2-(4-cyanophenoxy)propionic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C24H23NO5 MolecularWeight: 405.44312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C(C)OC3=CC=C(C=C3)C#N)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)[C@H](C)OC3=CC=C(C=C3)C#N)C(C)C

InChI

InChI=1S/C24H23NO5/c1-14(2)20-11-21-18(10-23(26)30-22(21)9-15(20)3)13-28-24(27)16(4)29-19-7-5-17(12-25)6-8-19/h5-11,14,16H,13H2,1-4H3/t16-/m0/s1