1-[2-(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)acetyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)-1-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(7-hydroxy-8-methyl-2-oxochromen-4-yl)acetyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(7-hydroxy-2-keto-8-methyl-chromen-4-yl)acetyl]proline Formula: C17H17NO6 MolecularWeight: 331.31998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CC(=O)N3CCCC3C(=O)O)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CC(=O)N3CCCC3C(=O)O)O

InChI

InChI=1S/C17H17NO6/c1-9-13(19)5-4-11-10(8-15(21)24-16(9)11)7-14(20)18-6-2-3-12(18)17(22)23/h4-5,8,12,19H,2-3,6-7H2,1H3,(H,22,23)