ethyl (4S)-2-azanyl-4-(4-bromophenyl)-6-(hydroxymethyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carboxylate

Systemtic Name: ethyl (4S)-2-azanyl-4-(4-bromophenyl)-6-(hydroxymethyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carboxylate Openeye Name: ethyl (4S)-2-amino-4-(4-bromophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carboxylate CAS Name: (4S)-2-amino-4-(4-bromophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-2-amino-4-(4-bromophenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carboxylate Traditional Name: (4S)-2-amino-4-(4-bromophenyl)-8-keto-6-methylol-4H-pyrano[3,2-b]pyran-3-carboxylic acid ethyl ester Formula: C18H16BrNO6 MolecularWeight: 422.22674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC=C(C=C3)Br)OC(=CC2=O)CO)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C([C@H]1C3=CC=C(C=C3)Br)OC(=CC2=O)CO)N

InChI

InChI=1S/C18H16BrNO6/c1-2-24-18(23)14-13(9-3-5-10(19)6-4-9)16-15(26-17(14)20)12(22)7-11(8-21)25-16/h3-7,13,21H,2,8,20H2,1H3/t13-/m0/s1