2-[fluoranyl-[4-(2-oxidanylidenepiperidin-1-yl)phenyl]carbamoyl]-4-methoxy-pyrrolidine-1-carboxylic acid

Systemtic Name: 2-[fluoranyl-[4-(2-oxidanylidenepiperidin-1-yl)phenyl]carbamoyl]-4-methoxy-pyrrolidine-1-carboxylic acid Openeye Name: 2-[fluoro-[4-(2-oxo-1-piperidyl)phenyl]carbamoyl]-4-methoxy-pyrrolidine-1-carboxylic acid CAS Name: 2-[[N-fluoro-4-(2-oxo-1-piperidinyl)anilino]-oxomethyl]-4-methoxy-1-pyrrolidinecarboxylic acid IUPAC Name: 2-[fluoro-[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]-4-methoxypyrrolidine-1-carboxylic acid Traditional Name: 2-[fluoro-[4-(2-ketopiperidino)phenyl]carbamoyl]-4-methoxy-pyrrolidine-1-carboxylic acid Formula: C18H22FN3O5 MolecularWeight: 379.382783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)O)C(=O)N(C2=CC=C(C=C2)N3CCCCC3=O)F

Isomeric SMILES

COC1CC(N(C1)C(=O)O)C(=O)N(C2=CC=C(C=C2)N3CCCCC3=O)F

InChI

InChI=1S/C18H22FN3O5/c1-27-14-10-15(21(11-14)18(25)26)17(24)22(19)13-7-5-12(6-8-13)20-9-3-2-4-16(20)23/h5-8,14-15H,2-4,9-11H2,1H3,(H,25,26)