(1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl) (2S)-1-(2-oxidanylidenechromen-4-yl)pyrrolidine-2-carboxylate

Systemtic Name: (1-methoxy-4-methyl-1-oxidanylidene-pentan-2-yl) (2S)-1-(2-oxidanylidenechromen-4-yl)pyrrolidine-2-carboxylate Openeye Name: (1-methoxycarbonyl-3-methyl-butyl) (2S)-1-(2-oxochromen-4-yl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(2-oxo-1-benzopyran-4-yl)-2-pyrrolidinecarboxylic acid (1-methoxy-4-methyl-1-oxopentan-2-yl) ester IUPAC Name: (1-methoxy-4-methyl-1-oxopentan-2-yl) (2S)-1-(2-oxochromen-4-yl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-ketochromen-4-yl)pyrrolidine-2-carboxylic acid (1-carbomethoxy-3-methyl-butyl) ester Formula: C21H25NO6 MolecularWeight: 387.4263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)OC(=O)C1CCCN1C2=CC(=O)OC3=CC=CC=C32

Isomeric SMILES

CC(C)CC(C(=O)OC)OC(=O)[C@@H]1CCCN1C2=CC(=O)OC3=CC=CC=C32

InChI

InChI=1S/C21H25NO6/c1-13(2)11-18(21(25)26-3)28-20(24)15-8-6-10-22(15)16-12-19(23)27-17-9-5-4-7-14(16)17/h4-5,7,9,12-13,15,18H,6,8,10-11H2,1-3H3/t15-,18?/m0/s1