(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-(phenylcarbamoylamino)propanoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-(phenylcarbamoylamino)propanoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl (2S)-2-(phenylcarbamoylamino)propanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]propanoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl (2S)-2-(phenylcarbamoylamino)propanoate Traditional Name: (2S)-2-(phenylcarbamoylamino)propionic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)O)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)O)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H18N2O6/c1-12(21-20(26)22-14-5-3-2-4-6-14)19(25)27-11-13-9-18(24)28-17-10-15(23)7-8-16(13)17/h2-10,12,23H,11H2,1H3,(H2,21,22,26)/t12-/m0/s1