(2R)-2-[2-oxidanylidene-3-(propan-2-ylcarbamoyl)chromen-7-yl]oxypropanoate

Systemtic Name: (2R)-2-[2-oxidanylidene-3-(propan-2-ylcarbamoyl)chromen-7-yl]oxypropanoate Openeye Name: (2R)-2-[3-(isopropylcarbamoyl)-2-oxo-chromen-7-yl]oxypropanoate CAS Name: (2R)-2-[[2-oxo-3-[oxo-(propan-2-ylamino)methyl]-1-benzopyran-7-yl]oxy]propanoate IUPAC Name: (2R)-2-[2-oxo-3-(propan-2-ylcarbamoyl)chromen-7-yl]oxypropanoate Traditional Name: (2R)-2-[3-(isopropylcarbamoyl)-2-keto-chromen-7-yl]oxypropionate Formula: C16H16NO6- MolecularWeight: 318.30134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC2=C(C=C(C=C2)OC(C)C(=O)[O-])OC1=O

Isomeric SMILES

C[C@H](C(=O)[O-])OC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NC(C)C

InChI

InChI=1S/C16H17NO6/c1-8(2)17-14(18)12-6-10-4-5-11(22-9(3)15(19)20)7-13(10)23-16(12)21/h4-9H,1-3H3,(H,17,18)(H,19,20)/p-1/t9-/m1/s1