(2S)-1-[2-(7-methoxy-2-oxidanylidene-chromen-4-yl)ethanoyl]pyrrolidine-2-carboxylic acid

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)N3CCCC3C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)N3CCC[C@H]3C(=O)O

InChI

InChI=1S/C17H17NO6/c1-23-11-4-5-12-10(8-16(20)24-14(12)9-11)7-15(19)18-6-2-3-13(18)17(21)22/h4-5,8-9,13H,2-3,6-7H2,1H3,(H,21,22)/t13-/m0/s1