[4,5-bis(oxidanylidene)pyran-2-yl]methyl N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: [4,5-bis(oxidanylidene)pyran-2-yl]methyl N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: (4,5-dioxopyran-2-yl)methyl N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]carbamic acid (4,5-dioxo-2-pyranyl)methyl ester IUPAC Name: (4,5-dioxopyran-2-yl)methyl N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]carbamic acid (4,5-diketopyran-2-yl)methyl ester Formula: C16H16N2O6 MolecularWeight: 332.30804

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=O)C=C(O1)COC(=O)NC(CC2=CC=CC=C2)C(=O)N

Isomeric SMILES

C1C(=O)C(=O)C=C(O1)COC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C16H16N2O6/c17-15(21)12(6-10-4-2-1-3-5-10)18-16(22)24-8-11-7-13(19)14(20)9-23-11/h1-5,7,12H,6,8-9H2,(H2,17,21)(H,18,22)/t12-/m0/s1