ethyl (2S)-2-[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxypropanoate

Systemtic Name: ethyl (2S)-2-[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxypropanoate Openeye Name: ethyl (2S)-2-(3-benzyl-4,8-dimethyl-2-oxo-chromen-7-yl)oxypropanoate CAS Name: (2S)-2-[[4,8-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxypropanoate Traditional Name: (2S)-2-(3-benzyl-2-keto-4,8-dimethyl-chromen-7-yl)oxypropionic acid ethyl ester Formula: C23H24O5 MolecularWeight: 380.43366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=C(C2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)[C@H](C)OC1=C(C2=C(C=C1)C(=C(C(=O)O2)CC3=CC=CC=C3)C)C

InChI

InChI=1S/C23H24O5/c1-5-26-22(24)16(4)27-20-12-11-18-14(2)19(13-17-9-7-6-8-10-17)23(25)28-21(18)15(20)3/h6-12,16H,5,13H2,1-4H3/t16-/m0/s1