[1-[2-fluoranyl-4-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]phenyl]pyrrolidin-3-yl]methylcarbamic acid

Systemtic Name: [1-[2-fluoranyl-4-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]phenyl]pyrrolidin-3-yl]methylcarbamic acid Openeye Name: [1-[4-[(2-benzyloxy-2-oxo-ethyl)amino]-2-fluoro-phenyl]pyrrolidin-3-yl]methylcarbamic acid CAS Name: [1-[2-fluoro-4-[(2-oxo-2-phenylmethoxyethyl)amino]phenyl]-3-pyrrolidinyl]methylcarbamic acid IUPAC Name: [1-[2-fluoro-4-[(2-oxo-2-phenylmethoxyethyl)amino]phenyl]pyrrolidin-3-yl]methylcarbamic acid Traditional Name: [1-[4-[(2-benzoxy-2-keto-ethyl)amino]-2-fluoro-phenyl]pyrrolidin-3-yl]methylcarbamic acid Formula: C21H24FN3O4 MolecularWeight: 401.431363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1CNC(=O)O)C2=C(C=C(C=C2)NCC(=O)OCC3=CC=CC=C3)F

Isomeric SMILES

C1CN(CC1CNC(=O)O)C2=C(C=C(C=C2)NCC(=O)OCC3=CC=CC=C3)F

InChI

InChI=1S/C21H24FN3O4/c22-18-10-17(23-12-20(26)29-14-15-4-2-1-3-5-15)6-7-19(18)25-9-8-16(13-25)11-24-21(27)28/h1-7,10,16,23-24H,8-9,11-14H2,(H,27,28)