(3S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-keto-pyrrolidine-3-carboxylate Formula: C14H14NO5- MolecularWeight: 276.26466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)N3CCC(C3=O)C(=O)[O-])OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)N3CC[C@@H](C3=O)C(=O)[O-])OC1

InChI

InChI=1S/C14H15NO5/c16-13-10(14(17)18)4-5-15(13)9-2-3-11-12(8-9)20-7-1-6-19-11/h2-3,8,10H,1,4-7H2,(H,17,18)/p-1/t10-/m0/s1