(4,7-dimethyl-2-oxidanylidene-chromen-5-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (4,7-dimethyl-2-oxidanylidene-chromen-5-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (4,7-dimethyl-2-oxo-chromen-5-yl) (2S)-2-(benzyloxycarbonylamino)propanoate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)propanoic acid (4,7-dimethyl-2-oxo-1-benzopyran-5-yl) ester IUPAC Name: (4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)propionic acid (2-keto-4,7-dimethyl-chromen-5-yl) ester Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OC(=O)C(C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OC(=O)[C@H](C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H21NO6/c1-13-9-17-20(14(2)11-19(24)28-17)18(10-13)29-21(25)15(3)23-22(26)27-12-16-7-5-4-6-8-16/h4-11,15H,12H2,1-3H3,(H,23,26)/t15-/m0/s1