(4-ethyl-7-methyl-2-oxidanylidene-chromen-5-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (4-ethyl-7-methyl-2-oxidanylidene-chromen-5-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (4-ethyl-7-methyl-2-oxo-chromen-5-yl) (2S)-2-(benzyloxycarbonylamino)propanoate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)propanoic acid (4-ethyl-7-methyl-2-oxo-1-benzopyran-5-yl) ester IUPAC Name: (4-ethyl-7-methyl-2-oxochromen-5-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)propionic acid (4-ethyl-2-keto-7-methyl-chromen-5-yl) ester Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)[C@H](C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H23NO6/c1-4-17-12-20(25)29-18-10-14(2)11-19(21(17)18)30-22(26)15(3)24-23(27)28-13-16-8-6-5-7-9-16/h5-12,15H,4,13H2,1-3H3,(H,24,27)/t15-/m0/s1